data_2js1_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 2js1 _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 ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -67.52 -41.63 32.46 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.943 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 59.1 Cg_exo -49.58 -24.84 9.96 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 C-N-CA 121.727 1.618 . . . . 0.0 111.915 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.59 -40.92 89.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.022 0.439 . . . . 0.0 110.362 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.467 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.6 m-85 -59.31 -42.38 91.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.232 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -65.88 -43.93 92.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.025 0.441 . . . . 0.0 110.421 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -50.84 -29.74 12.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.55 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -69.87 -35.73 74.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 110.57 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.2 mt -67.36 -38.53 84.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -55.91 -36.22 67.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' A' ' 20' ' ' MET . 65.9 tt0 -69.4 -36.69 76.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.5 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -60.88 -50.86 71.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.1 pt -72.07 -43.65 66.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.155 0.502 . . . . 0.0 110.942 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.5 tp10 -66.53 -51.74 53.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.391 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.401 ' N ' ' O ' ' A' ' 16' ' ' GLN . 36.1 mtt -104.51 -157.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 0.0 109.856 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.515 ' C ' ' H ' ' A' ' 23' ' ' SER . 61.4 t30 -142.77 62.58 1.4 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.455 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.447 ' O ' ' OG ' ' A' ' 23' ' ' SER . 6.1 tp-100 -73.01 39.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.528 0.68 . . . . 0.0 110.87 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.515 ' H ' ' C ' ' A' ' 21' ' ' ASN . 5.0 p 75.76 50.86 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.402 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 12.6 tp10 -143.62 -137.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.718 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -151.78 -164.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.373 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -84.25 -105.42 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.467 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.473 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.3 mt -62.21 -41.79 92.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -57.61 -6.03 0.44 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.457 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.473 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -61.2 -45.12 95.89 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.185 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.6 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -63.42 -45.46 90.85 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.216 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.587 ' N ' ' SD ' ' A' ' 30' ' ' MET . 55.4 t30 -53.47 -49.72 66.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.047 -0.661 . . . . 0.0 110.65 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 77.0 p -63.33 -50.39 70.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.03 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.467 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 48.2 t80 -69.33 -22.07 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.746 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 30' ' ' MET . 40.2 t80 -74.81 -56.65 4.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.304 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' A' ' 39' ' ' SER . 6.7 ptm85 -60.22 -25.25 65.48 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 120.984 0.421 . . . . 0.0 110.325 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.8 t -72.31 -45.99 57.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.865 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -66.68 -63.03 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.494 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.0 m -46.33 -40.49 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.523 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 35' ' ' ARG . 37.6 m -59.2 -39.64 83.29 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.2 m -74.42 -44.56 51.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.572 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.446 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 91.0 mt -56.51 -22.93 36.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.604 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.8 t -92.32 -28.34 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.594 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -90.37 -38.33 13.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.39 0.614 . . . . 0.0 110.813 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.451 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 26.2 p-10 -42.55 -59.4 1.9 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.986 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.432 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 13.3 pt20 -167.76 124.21 1.1 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.557 0.694 . . . . 0.0 110.395 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mp -94.7 51.72 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.378 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t -60.37 -31.33 70.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.221 0.534 . . . . 0.0 110.374 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -169.65 128.1 0.94 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 8.0 p30 -49.31 -33.3 12.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.179 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -71.93 -49.37 38.23 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.785 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.1 t -46.9 -38.68 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.37 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.21 -34.56 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.267 0.556 . . . . 0.0 111.099 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -62.82 -46.46 87.84 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.026 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -40.44 94.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.008 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -65.98 -39.79 90.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.283 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 86.6 mt -66.27 -46.24 87.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -58.1 -34.95 70.74 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -69.82 -42.21 73.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.16 -29.49 45.71 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.549 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -52.62 -29.91 28.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.543 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -63.45 -32.95 74.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.142 0.496 . . . . 0.0 110.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.41 -58.1 4.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.765 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.529 ' OH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -52.02 -43.41 63.69 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 110.071 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -64.29 -33.73 76.49 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.386 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -64.2 -39.22 93.53 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.575 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.25 -51.33 72.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.394 0.616 . . . . 0.0 110.435 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -65.32 -45.97 82.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.842 0.829 . . . . 0.0 111.333 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -54.42 -25.42 24.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.127 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.12 -12.72 82.96 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 0.0 110.408 179.906 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.45 -0.46 0 CA-C-O 120.948 0.404 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 74.4 t -57.49 -49.72 92.23 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.971 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 8.7 Cg_endo -47.44 -23.81 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.349 1.366 . . . . 0.0 112.279 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -63.62 -42.56 98.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.089 0.471 . . . . 0.0 110.651 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.478 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.71 -43.91 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.366 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 67.5 mt -69.18 -44.01 81.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.2 0.524 . . . . 0.0 110.569 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -50.72 -26.78 5.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.337 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -72.67 -31.79 65.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.893 0.378 . . . . 0.0 110.278 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.98 -36.17 69.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.529 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -55.82 -39.37 71.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.989 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -65.64 -36.39 83.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -62.84 -51.41 67.14 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.635 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.6 pt -73.02 -43.2 59.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.087 0.47 . . . . 0.0 110.811 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -64.97 -55.2 20.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.687 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 42.7 mtt -98.05 -145.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 p30 -170.63 46.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.153 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . 0.425 ' O ' ' OG ' ' B' ' 23' ' ' SER . 85.7 mt-30 -55.01 -44.72 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.554 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 3.6 m -179.97 69.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.148 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -165.08 -134.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.32 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -156.94 -167.44 2.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.346 0.593 . . . . 0.0 110.014 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -83.23 -106.07 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.585 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.501 ' C ' ' H ' ' B' ' 29' ' ' ALA . 21.3 tt -63.0 -34.57 67.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -67.59 8.09 0.4 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.779 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.501 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.48 -45.25 39.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.679 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.536 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -60.9 -46.67 89.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.834 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.79 -46.14 67.49 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.516 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -67.56 -54.17 22.21 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.835 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.478 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -61.76 -46.17 90.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.252 0.548 . . . . 0.0 110.669 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' B' ' 30' ' ' MET . 68.5 t80 -55.98 -47.11 78.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.741 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.529 ' NH2' ' OH ' ' A' ' 63' ' ' TYR . 76.0 ttt180 -66.16 -34.22 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -62.33 -45.01 95.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 110.649 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 85.5 t -69.26 -44.87 80.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.501 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 65.5 t -51.25 -48.19 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.434 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 78.4 p -56.39 -43.05 78.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.473 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.43 ' O ' ' N ' ' B' ' 44' ' ' ASP . 95.8 m -64.38 -44.62 90.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.674 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 93.1 mt -60.85 -47.29 87.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.508 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.11 -40.84 86.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 110.369 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . 0.483 ' O ' ' C ' ' B' ' 44' ' ' ASP . 94.8 mt-30 -72.97 -32.39 65.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.151 0.5 . . . . 0.0 110.655 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 43' ' ' GLN . 67.0 t0 -28.5 -84.2 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.147 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . 0.51 ' O ' ' N ' ' B' ' 47' ' ' THR . 26.5 pt20 -162.78 9.76 0.06 Allowed 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.47 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' B' ' 45' ' ' GLN . 1.1 tt 26.03 42.0 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.031 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.51 ' N ' ' O ' ' B' ' 45' ' ' GLN . 5.2 t -60.05 -33.01 71.47 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.447 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -154.32 127.43 8.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.592 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -47.45 -33.53 6.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.9 -50.22 57.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.2 t -50.79 -46.46 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.318 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -76.22 -39.93 35.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.378 0.608 . . . . 0.0 111.406 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -66.56 -40.56 89.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.896 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.405 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 17.8 mtpp -58.18 -44.87 88.24 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.172 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -65.62 -34.94 79.39 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.977 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.2 mm -69.08 -48.19 70.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.419 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -59.58 -43.5 93.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.128 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 64.9 m-70 -69.86 -45.48 67.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.441 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 51.2 tp -51.57 -28.68 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.03 -29.37 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.394 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.02 -35.5 73.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.61 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.04 -49.39 37.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.773 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -55.48 -42.06 73.84 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.486 HD22 ' NH2' ' B' ' 68' ' ' ARG . 48.3 t30 -68.56 -36.84 79.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.281 0.562 . . . . 0.0 110.854 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -60.33 -41.37 93.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.46 -47.85 79.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.67 0.748 . . . . 0.0 110.608 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -44.61 94.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.926 0.87 . . . . 0.0 111.381 -179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . 0.486 ' NH2' HD22 ' B' ' 64' ' ' ASN . 42.6 ttm180 -63.74 -21.14 66.26 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.964 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.48 -20.21 14.0 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.666 0.269 . . . . 0.0 110.613 -179.688 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.506 0 CA-C-O 120.956 0.408 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.602 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.6 t -67.31 -39.3 19.77 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.051 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 60.7 Cg_exo -53.08 -25.97 30.88 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 121.834 1.689 . . . . 0.0 111.951 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -60.18 -43.19 96.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 0.0 110.422 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.474 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.3 m-85 -57.08 -40.46 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.08 -44.2 84.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.09 0.472 . . . . 0.0 110.352 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -51.13 -30.75 17.41 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.614 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -69.08 -32.07 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.501 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.21 -38.63 66.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.4 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -56.09 -34.01 65.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.105 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -67.77 -33.42 74.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.402 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -65.35 -51.42 60.63 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.785 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.16 -40.07 65.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.321 0.581 . . . . 0.0 110.782 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -67.83 -53.78 24.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.136 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.419 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 44.7 mtt -98.74 -65.0 0.99 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.091 0.472 . . . . 0.0 110.086 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 21.0 t30 80.99 47.91 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.878 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -53.27 -40.76 64.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.299 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.2 p -158.87 64.91 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -161.89 -132.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.334 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 64.5 m-20 -158.66 -172.03 3.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.36 0.6 . . . . 0.0 110.062 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -77.73 -104.62 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.593 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.584 ' C ' ' H ' ' A' ' 29' ' ' ALA . 16.2 tt -63.97 -36.02 75.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.046 0.451 . . . . 0.0 110.768 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -68.05 16.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.584 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.92 -44.99 21.46 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.246 0.546 . . . . 0.0 110.263 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.647 ' O ' ' N ' ' A' ' 34' ' ' TYR . 26.3 tpp -61.9 -48.59 79.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.957 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.495 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 62.6 t-20 -47.28 -53.23 14.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.724 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.1 m -62.1 -50.31 72.43 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.959 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.474 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 40.8 t80 -67.2 -21.97 65.75 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.647 ' N ' ' O ' ' A' ' 30' ' ' MET . 45.2 t80 -73.91 -60.33 2.31 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.342 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.426 ' O ' ' OG ' ' A' ' 39' ' ' SER . 16.7 ptm180 -61.16 -26.33 67.62 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.922 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.406 ' O ' ' OG1' ' A' ' 40' ' ' THR . 42.2 t -66.23 -47.89 72.33 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.708 0.289 . . . . 0.0 110.491 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.6 -48.06 60.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.422 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.46 -53.96 40.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.716 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.426 ' OG ' ' O ' ' A' ' 35' ' ' ARG . 13.6 m -59.7 -18.39 42.02 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.36 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 36' ' ' SER . 23.0 m -87.51 -49.32 7.27 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.102 0.477 . . . . 0.0 111.078 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 43' ' ' GLN . 96.6 mt -70.81 -42.85 69.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.66 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.415 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 43.4 t -78.3 27.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.401 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 41' ' ' LEU . 74.6 mt-30 -147.61 2.92 0.73 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.729 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 46' ' ' LEU . 38.5 t70 -150.37 168.09 25.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.133 0.492 . . . . 0.0 110.278 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 67.31 -64.86 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.504 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.1 mt 36.96 43.34 0.29 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.332 0.587 . . . . 0.0 111.183 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 t -76.53 -31.85 57.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.425 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -170.82 131.32 0.84 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.645 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -50.07 -37.69 34.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.626 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.87 -48.46 71.47 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.315 0.578 . . . . 0.0 110.555 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -53.39 -44.02 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.628 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.12 -36.63 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-O 121.012 0.434 . . . . 0.0 111.09 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.22 -47.66 83.45 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.71 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 15.5 pttp -50.2 -38.44 40.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.206 0.527 . . . . 0.0 110.21 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 mmm180 -64.55 -38.4 90.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.173 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.01 -51.12 73.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.302 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -53.58 -45.29 69.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.367 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.409 ' N ' ' HD1' ' A' ' 58' ' ' HIS . 2.2 m80 -65.08 -38.28 90.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.54 -30.43 53.93 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.172 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -61.41 -32.1 72.04 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.036 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -59.31 -40.46 86.32 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.199 0.524 . . . . 0.0 110.844 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.63 -49.27 33.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.237 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -49.75 -43.1 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.944 -179.279 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.572 ' ND2' ' NE ' ' A' ' 68' ' ' ARG . 1.7 t-20 -66.95 -35.84 80.87 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.333 0.587 . . . . 0.0 110.372 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 30.7 tptt -69.61 -41.43 75.72 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.507 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -46.19 96.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 122.12 0.962 . . . . 0.0 110.664 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -66.84 -43.11 84.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.449 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.572 ' NE ' ' ND2' ' A' ' 64' ' ' ASN . 78.0 mtm180 -81.51 -15.14 55.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.454 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -92.88 -37.76 5.66 Favored Glycine 0 N--CA 1.471 1.012 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.055 0.455 . . . . 0.0 110.378 179.941 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.231 0.113 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.503 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -56.44 -45.49 99.92 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.197 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 88.5 Cg_exo -45.78 -23.52 1.64 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.533 1.489 . . . . 0.0 112.615 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.91 -39.96 91.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.354 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -60.36 -42.35 95.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.347 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.33 -45.3 98.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.056 0.455 . . . . 0.0 110.437 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -48.61 -28.38 3.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.577 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -74.37 -39.76 62.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.6 mt -69.49 -46.22 67.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.329 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -62.79 -26.06 68.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.459 0.647 . . . . 0.0 110.519 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -63.45 -29.63 70.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.569 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.573 ' NE2' ' O ' ' B' ' 25' ' ' ASP . 82.8 t60 -81.84 -61.56 1.88 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.258 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 pt -50.5 -37.25 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-O 121.385 0.612 . . . . 0.0 110.359 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -74.14 -55.5 6.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.662 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -101.52 -119.76 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.055 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.448 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 21.2 p-10 -176.42 74.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.258 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -79.89 -72.34 0.41 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.221 0.534 . . . . 0.0 110.245 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 28.5 p -172.99 85.19 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.359 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . 0.441 ' N ' ' CE1' ' B' ' 17' ' ' HIS . 9.4 tp10 -169.73 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.562 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . 0.573 ' O ' ' NE2' ' B' ' 17' ' ' HIS . 91.7 m-20 -135.36 -95.9 0.25 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.741 0.305 . . . . 0.0 110.339 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -163.13 -99.51 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.178 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.93 -40.59 89.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.131 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -71.18 -14.53 62.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.462 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.21 -40.4 5.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.76 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.558 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -66.17 -48.36 70.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.495 ' ND2' ' OD1' ' A' ' 31' ' ' ASN . 39.8 t-20 -57.1 -48.53 78.39 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.694 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 41.1 t -62.51 -44.72 95.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.347 0.594 . . . . 0.0 111.014 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -73.96 -46.75 42.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.869 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 50.5 t80 -49.15 -40.46 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.891 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.521 ' NH2' ' CG ' ' A' ' 34' ' ' TYR . 42.7 ttm180 -72.57 -30.22 64.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.088 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 12.5 t -61.56 -43.19 99.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 87.3 t -73.19 -43.73 56.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 110.577 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 88.6 t -54.71 -45.99 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.585 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 42.2 t -58.83 -41.62 87.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.381 . . . . 0.0 110.402 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 31.5 m -72.32 -46.03 57.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.207 0.527 . . . . 0.0 110.775 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.458 ' O ' ' OD1' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -53.33 -30.5 39.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.534 -179.451 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.9 t -90.71 -28.4 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.306 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -73.86 -22.4 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.48 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' B' ' 41' ' ' LEU . 44.9 p30 -79.99 -176.06 5.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.302 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -43.26 141.58 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.688 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -122.9 61.63 1.01 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.24 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.45 -31.54 72.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.936 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -168.08 126.84 1.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.848 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.491 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 23.4 p30 -46.87 -28.46 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.491 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -73.59 -51.25 17.52 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.289 0.566 . . . . 0.0 110.555 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.9 t -49.22 -44.94 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.657 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.0 m -73.4 -35.71 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-O 121.193 0.521 . . . . 0.0 110.742 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.53 -27.97 68.18 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.537 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.485 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 55.8 mttp -53.84 -44.44 70.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.987 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -68.65 -38.89 80.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.483 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 32.0 mm -63.33 -52.61 56.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.298 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -57.35 -37.69 72.98 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.485 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 27.6 m-70 -74.82 -44.29 50.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.514 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 31.9 tp -55.35 -29.67 58.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.239 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.418 ' OD1' ' OH ' ' B' ' 34' ' ' TYR . 87.9 m-20 -51.58 -38.76 55.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.333 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.75 -30.34 32.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.463 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.44 -54.02 14.05 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.487 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -50.05 -39.07 40.81 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.268 0.556 . . . . 0.0 110.074 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.483 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 50.2 t30 -72.66 -38.83 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . 0.608 ' HZ3' ' NH2' ' B' ' 68' ' ' ARG . 46.5 mmtt -61.66 -39.57 91.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.343 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.1 t -60.3 -50.16 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.15 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 17.8 mtmt -72.72 -49.88 28.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.54 0.686 . . . . 0.0 111.661 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . 0.608 ' NH2' ' HZ3' ' B' ' 65' ' ' LYS . 68.8 ttp85 -57.14 -32.22 66.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.86 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.65 -12.72 84.21 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 120.91 0.386 . . . . 0.0 110.559 -179.871 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.51 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -61.24 -43.75 91.09 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.6 Cg_exo -49.59 -27.46 14.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 121.104 1.203 . . . . 0.0 112.267 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.26 -42.45 99.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.527 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -58.61 -44.1 89.81 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 48.3 mt -67.44 -43.71 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.243 0.544 . . . . 0.0 110.595 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -51.94 -33.38 37.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.499 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -67.37 -32.06 72.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.077 0.465 . . . . 0.0 110.4 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.8 mt -71.41 -38.72 71.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.626 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -53.77 -34.37 58.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.046 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -66.8 -36.65 82.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.491 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -61.6 -51.91 66.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.652 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.42 -43.57 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.866 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -65.79 -51.87 55.43 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.472 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 34.9 mtt -104.5 -160.68 0.78 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.151 0.501 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -154.54 51.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.276 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -59.3 -50.56 73.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.962 0.41 . . . . 0.0 110.38 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 p -177.15 71.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.45 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -167.87 -132.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.307 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -155.44 -166.42 2.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.038 0.447 . . . . 0.0 110.406 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.92 -104.27 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.585 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.8 tt -63.41 -39.28 84.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 52.0 t-80 -63.39 10.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.159 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.585 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -76.93 -44.43 31.58 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.003 0.43 . . . . 0.0 110.638 178.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -62.86 -46.64 86.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.012 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' OD1' ' NH2' ' B' ' 35' ' ' ARG . 44.5 t30 -53.58 -48.97 68.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.641 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.4 p -64.77 -54.06 37.24 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.906 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -61.03 -42.72 99.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.316 0.579 . . . . 0.0 110.384 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.522 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.3 t80 -55.45 -48.06 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -75.56 -20.43 58.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.3 . . . . 0.0 110.471 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.9 t -68.22 -50.8 51.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.439 ' CG2' ' N ' ' A' ' 38' ' ' VAL . 4.7 m -74.82 -45.94 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.439 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 55.2 t -56.45 -48.27 80.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.824 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -61.23 -42.26 98.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.4 m -69.31 -46.81 66.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.801 0.334 . . . . 0.0 110.743 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.433 ' O ' ' O ' ' A' ' 44' ' ' ASP . 82.5 mt -62.66 -30.37 71.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.37 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 74.7 t -85.32 -38.01 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.49 -6.44 19.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.252 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' CB ' ' A' ' 45' ' ' GLN . 54.5 p30 -149.05 165.86 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.901 0.381 . . . . 0.0 110.506 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.45 HE22 ' NH2' ' A' ' 55' ' ' ARG . 51.0 tt0 82.78 -73.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.499 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt 43.52 42.28 3.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.119 0.485 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.8 m -62.27 -37.8 86.85 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.433 0.635 . . . . 0.0 110.227 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.471 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 57.9 tttp -178.6 145.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.516 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -57.43 -40.65 78.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.662 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.471 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -66.36 -47.74 72.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.021 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.0 t -53.58 -65.21 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.229 -178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.7 -32.14 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.955 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -41.15 96.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.883 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.402 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 25.1 mtpp -59.67 -41.98 91.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.098 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.45 ' NH2' HE22 ' A' ' 45' ' ' GLN . 94.0 mtt180 -65.18 -41.83 94.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.056 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.7 -51.55 49.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.429 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.438 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 15.4 mm100 -56.95 -41.19 77.85 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 19.2 m-70 -71.06 -41.88 70.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.689 0.28 . . . . 0.0 110.364 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.47 -22.56 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.598 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 4.3 p-10 -57.41 -30.49 64.98 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.486 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.5 pt-20 -60.7 -33.64 73.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 0.0 110.257 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.11 -57.46 4.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.883 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.98 -39.21 25.71 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.45 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 52.4 t30 -70.87 -39.95 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.931 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -60.66 -46.82 88.86 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 84.3 t -54.83 -55.07 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.163 -0.615 . . . . 0.0 110.326 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -60.35 -46.22 90.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.177 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.0 tpt85 -58.25 -14.06 6.41 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.719 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.88 9.1 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 . . . . . 0 C--N 1.329 -0.32 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.85 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.231 0.107 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.1 t -72.43 -38.48 5.34 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-O 119.306 -0.378 . . . . 0.0 109.992 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 59.6 Cg_exo -53.48 -28.61 45.5 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.379 1.386 . . . . 0.0 111.806 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -60.64 -44.46 96.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.68 0.276 . . . . 0.0 110.352 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.466 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.1 m-85 -58.18 -37.53 74.93 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.147 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.68 -47.1 72.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.37 -25.91 6.87 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.525 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -70.31 -31.42 68.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.373 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.69 -39.74 66.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.685 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -32.83 68.09 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.041 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.426 ' CD ' ' NE2' ' B' ' 22' ' ' GLN . 48.3 tt0 -66.37 -30.65 71.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.573 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -69.16 -51.98 32.74 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.712 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 pt -72.81 -44.44 58.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 121.044 0.45 . . . . 0.0 110.709 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.71 -53.02 57.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.693 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.9 mmt -96.29 -147.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 109.874 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -171.21 45.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.013 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . 0.426 ' NE2' ' CD ' ' B' ' 16' ' ' GLN . 50.2 mt-30 -54.85 -46.12 74.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.659 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t 178.52 68.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.445 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . 0.415 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 16.9 tp10 -160.9 -130.99 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.399 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -160.37 -171.81 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.362 0.601 . . . . 0.0 110.369 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -78.44 -106.45 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.132 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.525 ' C ' ' H ' ' B' ' 29' ' ' ALA . 20.0 tt -64.83 -32.79 59.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.615 0.245 . . . . 0.0 110.691 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.09 7.78 0.26 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.608 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.525 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.07 -43.0 36.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.267 0.556 . . . . 0.0 110.575 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.48 ' O ' ' N ' ' B' ' 34' ' ' TYR . 16.2 ptt? -59.45 -47.1 86.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.355 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.476 ' N ' ' CG ' ' B' ' 30' ' ' MET . 33.6 m120 -54.14 -43.41 70.51 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.501 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.415 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 78.3 p -70.65 -55.43 8.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.727 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.466 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 42.2 t80 -59.59 -46.15 89.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.216 0.531 . . . . 0.0 110.598 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' B' ' 30' ' ' MET . 59.4 t80 -55.77 -48.55 75.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.004 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.476 ' NH2' ' OD1' ' A' ' 31' ' ' ASN . 44.5 ttm180 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.393 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.5 t -70.04 -50.99 35.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.896 0.379 . . . . 0.0 110.488 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.0 t -68.18 -56.73 11.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.5 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 69.1 t -48.44 -49.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.328 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 71.3 m -57.81 -36.41 72.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.3 m -71.21 -49.99 37.73 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.949 0.404 . . . . 0.0 111.309 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.3 mt -53.23 -36.62 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.294 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.1 -38.63 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.411 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -115.93 78.16 1.16 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.407 0.622 . . . . 0.0 110.237 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -178.38 -69.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.765 0.793 . . . . 0.0 110.716 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 67.8 tp60 -86.34 -74.89 0.4 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.54 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tt 69.28 43.67 1.04 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.165 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -80.75 -27.69 36.73 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.334 0.587 . . . . 0.0 110.524 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -178.7 145.81 0.32 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.428 HD21 ' N ' ' A' ' 50' ' ' ALA . 18.3 p-10 -64.26 -45.03 89.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.56 -39.93 85.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.832 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 12.6 t -57.93 -62.11 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.845 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -54.19 -33.81 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.574 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.72 -60.63 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.689 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.456 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 16.8 ptpt -58.23 -35.59 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.929 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -62.91 -35.72 81.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.078 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 88.4 mt -71.23 -46.2 66.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.492 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -54.75 -25.37 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.14 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.456 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 50.8 m170 -70.2 -44.97 67.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.211 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -20.98 2.25 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.591 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -59.46 -45.31 91.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.178 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.14 -37.68 88.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.065 0.46 . . . . 0.0 110.654 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -53.89 11.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.913 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.03 -37.71 21.57 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.101 0.476 . . . . 0.0 109.773 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -65.6 -37.21 85.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.652 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 15.5 tptp -55.34 -39.57 70.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.717 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.24 -39.27 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-O 121.836 0.827 . . . . 0.0 110.515 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -64.91 -46.85 79.95 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.803 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -86.05 -12.24 50.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.336 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -92.57 -37.15 5.91 Favored Glycine 0 N--CA 1.476 1.364 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.012 0.434 . . . . 0.0 110.207 -179.879 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.688 0.28 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.464 ' CG1' ' NE2' ' A' ' 58' ' ' HIS . 1.0 OUTLIER -58.52 -46.52 99.6 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.748 179.001 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 99.1 Cg_exo -40.66 -29.78 0.46 Allowed 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 121.248 1.299 . . . . 0.0 112.764 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -59.15 -48.36 81.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.183 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -47.15 85.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.763 0.316 . . . . 0.0 110.26 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.9 mt -61.14 -47.44 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 121.324 0.583 . . . . 0.0 110.41 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -46.27 -32.55 3.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.745 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -60.85 -35.75 77.36 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.2 mp -76.52 -40.06 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.782 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -62.59 -35.43 79.5 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.867 0.365 . . . . 0.0 110.256 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.48 -29.94 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.584 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -72.68 -56.04 5.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.422 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 2.1 pt -67.38 -42.33 87.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.335 0.588 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.8 tt0 -62.24 -53.42 55.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.639 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.3 mtt -98.58 -132.4 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -170.35 50.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.449 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -58.1 -50.58 72.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.596 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.0 p -174.19 21.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -134.9 175.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.368 1.08 . . . . 0.0 109.806 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -112.23 -126.5 0.28 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.364 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -113.42 -87.93 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.663 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.4 mm -68.12 -24.17 29.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.683 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -84.67 -9.7 58.0 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.376 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 -51.23 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.828 0.347 . . . . 0.0 110.496 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.556 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -64.14 -41.06 97.35 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.556 ' N ' ' SD ' ' A' ' 30' ' ' MET . 50.3 t30 -56.62 -51.78 67.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.354 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.9 t -65.27 -51.36 61.3 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.773 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -60.71 -53.55 56.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.46 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 30' ' ' MET . 38.3 t80 -54.84 -48.75 72.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.903 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.3 tpt180 -60.28 -40.03 88.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.918 0.389 . . . . 0.0 110.183 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.1 m -64.8 -41.14 96.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.0 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.23 -60.44 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.63 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 39' ' ' SER . 8.3 p -52.15 -43.42 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.252 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.432 ' N ' ' CG1' ' A' ' 38' ' ' VAL . 69.6 m -62.53 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -57.94 -43.99 86.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.375 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.21 -45.63 62.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.259 0.552 . . . . 0.0 110.631 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.45 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 61.0 t -82.33 26.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.29 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -159.98 19.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.319 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -168.77 21.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.231 . . . . 0.0 110.467 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -172.3 62.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.488 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 30.8 mt -100.66 50.52 0.88 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.369 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.2 t -72.31 -34.68 68.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.385 0.612 . . . . 0.0 110.436 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -163.92 132.07 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.439 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 19.4 p30 -48.59 -36.63 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.605 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.439 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -69.18 -53.24 21.05 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 111.03 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.6 t -48.24 -44.31 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.564 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -75.8 -40.16 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.985 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 14.2 mt -59.34 -40.5 86.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.548 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -52.82 -50.2 64.14 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.531 -0.467 . . . . 0.0 109.921 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -62.38 -43.16 99.49 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.259 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.5 mt -64.01 -55.64 20.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.638 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -50.92 -41.26 58.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.167 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.464 ' NE2' ' CG1' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -73.05 -43.45 61.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.902 179.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.3 tp -56.89 -29.63 63.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.782 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -52.79 -52.56 56.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.246 -0.582 . . . . 0.0 110.377 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -51.39 -29.49 15.81 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.758 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.34 -62.26 1.57 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.764 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -43.36 64.69 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -61.61 -25.77 67.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.25 -179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.559 ' NZ ' ' NH2' ' A' ' 68' ' ' ARG . 31.2 tptt -75.1 -32.74 61.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.622 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.5 t -67.21 -52.4 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-O 121.367 0.604 . . . . 0.0 110.465 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -47.17 79.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.84 0.828 . . . . 0.0 111.6 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.559 ' NH2' ' NZ ' ' A' ' 65' ' ' LYS . 70.7 ttp85 -57.17 -24.74 56.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.981 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -84.22 -16.21 67.5 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 121.167 0.508 . . . . 0.0 110.492 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.507 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.4 t -60.58 -41.98 85.86 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.662 -0.685 . . . . 0.0 109.837 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.507 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 79.9 Cg_exo -47.21 -34.27 17.61 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 121.123 1.215 . . . . 0.0 112.223 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -55.45 -41.95 73.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.183 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.405 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -62.53 -44.83 95.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.383 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.414 ' O ' ' N ' ' B' ' 14' ' ' LEU . 30.5 mt -60.61 -48.29 89.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.456 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -45.31 -32.4 1.99 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.66 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -59.14 -35.31 73.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.475 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 7.0 mp -73.19 -38.22 66.22 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.775 0.321 . . . . 0.0 110.307 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.95 -34.41 77.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.043 0.449 . . . . 0.0 110.315 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -64.51 -28.85 69.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.626 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -72.18 -53.63 12.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.858 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 6.2 pt -70.63 -43.04 77.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.313 0.577 . . . . 0.0 110.729 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.09 -39.55 82.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.204 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -126.0 -135.26 0.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.907 0.385 . . . . 0.0 110.552 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -173.3 55.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.268 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -60.07 -44.82 94.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.285 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t 175.33 71.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -166.25 -124.76 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.798 0.332 . . . . 0.0 110.393 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -156.94 -168.71 2.73 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.312 0.577 . . . . 0.0 110.006 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -89.8 -98.63 0.1 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.37 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.426 ' C ' ' H ' ' B' ' 29' ' ' ALA . 3.1 mm -61.5 -44.42 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.811 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -57.58 -8.35 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.582 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.426 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -55.66 -48.34 75.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.532 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.427 ' O ' ' N ' ' B' ' 34' ' ' TYR . 2.3 ptm -67.15 -50.31 61.71 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.457 ' OD1' ' NH1' ' A' ' 35' ' ' ARG . 91.5 m-20 -56.89 -44.76 82.62 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.508 -179.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.434 ' HG ' ' H ' ' B' ' 33' ' ' TYR . 78.1 p -69.96 -51.23 34.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.805 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.434 ' H ' ' HG ' ' B' ' 32' ' ' SER . 44.5 t80 -63.63 -51.65 64.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.827 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.427 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.0 t80 -52.66 -44.44 66.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.022 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -69.33 -36.7 77.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.573 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 45.1 m -60.55 -39.12 86.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.407 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.74 -54.97 13.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.32 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 49.1 t -48.49 -38.21 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.501 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.442 ' O ' ' N ' ' B' ' 43' ' ' GLN . 77.6 p -64.95 -47.11 78.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.087 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -65.57 -46.12 80.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.445 0.641 . . . . 0.0 111.234 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -62.9 -34.99 78.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.651 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 79.2 t -85.59 -37.99 12.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' B' ' 39' ' ' SER . 47.8 tt0 -75.93 -0.5 21.66 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.661 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' B' ' 41' ' ' LEU . 46.6 m-20 -157.13 171.54 20.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 52.24 42.36 30.77 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.578 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.98 43.63 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.6 t -65.4 -43.21 91.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.446 0.641 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -158.22 131.47 7.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.643 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -46.54 -42.78 16.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.267 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.84 70.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.934 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 28.5 t -51.0 -46.85 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.451 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.3 m -76.3 -45.09 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 121.594 0.711 . . . . 0.0 111.146 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.84 -42.69 80.11 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.606 -178.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -53.48 -45.33 69.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.184 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.401 HH21 ' HD1' ' B' ' 58' ' ' HIS . 0.0 OUTLIER -60.45 -40.13 90.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 26.2 mm -65.43 -52.3 53.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -52.7 -47.25 67.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.185 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.401 ' HD1' HH21 ' B' ' 55' ' ' ARG . 54.5 m170 -67.09 -44.88 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.6 tp -52.17 -27.49 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.319 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -52.16 -45.11 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.348 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -50.07 -28.45 7.16 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.708 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.87 -63.49 1.05 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.705 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -47.47 -46.35 26.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.38 0.609 . . . . 0.0 110.083 -179.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.469 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.2 t-20 -59.22 -36.75 75.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.055 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.1 tptp -60.81 -34.29 74.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.439 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 60.0 t -69.92 -51.24 41.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.523 0.678 . . . . 0.0 110.497 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' B' ' 69' ' ' GLY . 5.4 mmmt -72.92 -21.75 60.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.564 1.173 . . . . 0.0 112.359 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -38.54 -27.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.685 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' B' ' 67' ' ' LYS . . . 155.27 66.67 0.01 OUTLIER Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . 0.439 ' CG ' ' O ' ' B' ' 66' ' ' VAL . 60.3 mm-40 . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.762 0.315 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.547 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 4.3 t -67.13 -42.4 40.43 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.107 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 68.2 Cg_exo -49.23 -24.37 8.12 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 121.529 1.486 . . . . 0.0 112.125 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -70.14 -41.29 74.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.183 0.516 . . . . 0.0 110.449 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -62.81 -47.29 84.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.274 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.11 -42.97 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.342 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -49.27 -25.15 2.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.717 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -75.63 -38.03 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.077 0.465 . . . . 0.0 110.599 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 mt -63.71 -39.33 94.03 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.548 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -55.32 -36.74 66.54 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.236 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.6 tt0 -65.77 -32.42 73.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.517 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.69 -52.28 46.49 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.806 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 pt -73.96 -45.94 47.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.848 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -66.84 -50.37 62.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.144 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.426 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 4.1 tpp -94.79 -165.11 1.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.696 0.76 . . . . 0.0 109.934 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -154.56 44.11 0.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.257 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -56.98 -53.36 58.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.177 0.513 . . . . 0.0 110.286 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -174.73 70.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.385 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.401 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 14.2 tp10 -164.71 -135.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.964 0.411 . . . . 0.0 110.204 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -156.57 -165.93 2.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.46 0.648 . . . . 0.0 109.928 -179.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.511 ' HZ3' ' H ' ' A' ' 27' ' ' ILE . 17.9 ttpp -85.0 -103.23 0.05 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.451 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.566 ' C ' ' H ' ' A' ' 29' ' ' ALA . 3.3 mm -63.02 -38.99 83.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -64.54 8.34 0.12 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.804 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.566 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.46 -48.47 22.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.458 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.527 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.45 -43.94 96.33 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.277 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' ' SD ' ' A' ' 30' ' ' MET . 13.5 m120 -52.42 -46.18 66.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.323 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.401 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 79.6 p -70.74 -54.88 10.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.806 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 44.5 t80 -58.88 -49.26 78.43 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.243 0.544 . . . . 0.0 110.669 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 30' ' ' MET . 72.0 t80 -58.07 -48.47 80.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.904 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -66.74 -36.27 82.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.958 0.409 . . . . 0.0 110.41 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -62.77 -44.2 96.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.634 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -71.55 -51.83 30.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.374 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 88.3 t -51.19 -48.81 31.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.246 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -60.45 -39.61 88.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.2 m -65.7 -48.19 72.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.271 0.557 . . . . 0.0 110.863 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 44' ' ' ASP . 99.1 mt -56.91 -33.36 66.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.758 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -87.34 -38.47 12.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.309 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -53.17 -12.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.664 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.447 ' O ' ' O ' ' A' ' 41' ' ' LEU . 3.4 m-20 -173.01 -172.88 0.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.178 0.513 . . . . 0.0 110.003 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 58.04 33.22 22.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.96 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.63 44.33 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.452 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -64.31 -29.65 70.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.587 . . . . 0.0 110.702 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.429 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 87.8 tttt -168.22 131.3 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.713 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.639 HD21 ' N ' ' A' ' 50' ' ' ALA . 0.4 OUTLIER -48.42 -38.22 19.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.524 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.639 ' N ' HD21 ' A' ' 49' ' ' ASN . . . -67.05 -49.06 66.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.803 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -51.83 -45.11 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.374 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.4 m -77.79 -43.72 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.835 0.826 . . . . 0.0 111.116 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.69 -41.73 98.1 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.264 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -53.11 -40.01 63.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.987 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.435 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 53.1 mtp180 -67.51 -35.45 79.14 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 52' ' ' VAL . 40.9 mm -65.05 -51.11 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.58 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -57.65 -39.35 76.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.435 ' ND1' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -72.81 -46.37 53.49 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.089 0.471 . . . . 0.0 110.167 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.431 ' N ' ' CG ' ' A' ' 58' ' ' HIS . 29.5 tp -55.71 -25.02 38.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.631 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.39 -34.92 73.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.987 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.28 -32.24 72.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.955 0.407 . . . . 0.0 110.477 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.98 -54.27 13.99 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.81 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.421 ' HH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.22 -46.71 69.21 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.966 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -62.49 -34.5 76.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.266 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -63.12 -37.85 88.87 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.404 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.8 t -57.86 -53.64 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.197 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -64.69 -44.27 90.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.746 0.784 . . . . 0.0 111.4 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -53.87 -27.86 32.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.019 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -86.09 -15.05 65.6 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 121.106 0.479 . . . . 0.0 110.229 -179.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' SER . . . . . 0.496 ' O ' ' N ' ' B' ' 9' ' ' TYR . 8.4 p . . . . . 0 CA--C 1.53 0.177 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.462 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.8 t -35.77 -54.66 1.31 Allowed Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.701 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 12.6 Cg_endo -51.42 -21.59 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 121.305 1.337 . . . . 0.0 112.331 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' B' ' 6' ' ' SER . 16.8 t80 -64.98 -47.54 77.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.338 0.589 . . . . 0.0 110.713 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.44 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.9 OUTLIER -72.95 -47.54 44.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.359 -179.472 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.5 mt -58.79 -42.15 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.159 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -47.42 -26.03 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.665 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . 0.637 ' ND2' ' HE2' ' B' ' 17' ' ' HIS . 54.3 t30 -74.08 -43.64 56.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.508 . . . . 0.0 110.464 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.96 -36.42 77.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.896 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . 0.45 ' NZ ' ' OE1' ' B' ' 19' ' ' GLU . 26.3 ttpp -58.78 -46.81 86.67 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.01 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.56 -29.05 69.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.578 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.637 ' HE2' ' ND2' ' B' ' 13' ' ' ASN . 5.7 m-70 -68.19 -52.7 31.47 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.686 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 9.4 pt -74.78 -46.2 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.014 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . 0.45 ' OE1' ' NZ ' ' B' ' 15' ' ' LYS . 82.7 tt0 -56.0 -54.66 42.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.553 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 45.7 mtt -97.87 -137.53 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.866 0.365 . . . . 0.0 110.039 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -171.38 43.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.305 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -55.99 -47.84 76.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.3 p -173.9 68.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.318 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -166.9 -137.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.927 0.394 . . . . 0.0 110.422 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -156.27 -156.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.397 0.618 . . . . 0.0 109.891 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -93.81 -103.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.978 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.496 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.1 mm -62.18 -39.36 83.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -67.77 7.56 0.49 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.653 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.75 -48.39 22.0 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.05 0.453 . . . . 0.0 110.651 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.631 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -64.68 -46.05 84.03 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.298 179.51 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.555 ' N ' ' SD ' ' B' ' 30' ' ' MET . 26.0 t-20 -51.18 -52.86 40.22 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.064 -0.655 . . . . 0.0 110.912 -178.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 10.8 t -60.64 -46.84 88.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.791 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.44 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 47.1 t80 -72.79 -20.03 61.24 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.623 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.631 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.0 t80 -73.79 -55.43 6.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.289 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.421 ' NH2' ' HH ' ' A' ' 63' ' ' TYR . 9.4 ptm180 -65.37 -26.59 68.08 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.415 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' B' ' 40' ' ' THR . 82.8 p -66.57 -46.56 75.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.35 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 55.8 t -70.18 -49.63 53.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.149 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.49 -49.28 84.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.361 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -65.5 -17.86 64.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 110.633 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' B' ' 36' ' ' SER . 27.7 m -87.32 -52.02 5.62 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.84 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' B' ' 43' ' ' GLN . 97.8 mt -66.99 -40.92 87.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.609 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . 0.427 ' O ' ' CG1' ' B' ' 42' ' ' VAL . 61.7 t -77.89 18.4 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.048 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . 0.439 ' H ' ' C ' ' B' ' 41' ' ' LEU . 75.6 mt-30 -145.13 -1.45 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.727 0.299 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -114.2 -30.61 6.58 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.491 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -152.24 86.83 1.3 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.936 0.398 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.13 40.08 1.74 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.506 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -62.81 -17.94 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 110.401 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.635 ' O ' HG22 ' B' ' 51' ' ' VAL . 16.9 tptm -168.19 122.72 0.94 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.184 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -54.43 -15.98 2.01 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.049 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' B' ' 53' ' ' LEU . . . -80.31 -59.62 2.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.012 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . 0.635 HG22 ' O ' ' B' ' 48' ' ' LYS . 23.1 m -45.93 -36.74 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.58 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 32.7 m -77.53 -31.95 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.724 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' B' ' 50' ' ' ALA . 50.1 tp -58.05 -37.91 75.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.948 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.428 ' C ' ' HE ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -58.89 -45.48 90.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.386 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.546 ' HE ' ' N ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -64.3 -44.23 92.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.777 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.38 -51.54 69.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.581 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -56.52 -44.45 80.8 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.544 ' ND1' HH21 ' B' ' 55' ' ' ARG . 47.1 m170 -68.3 -42.09 79.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 tp -52.15 -26.03 10.39 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.741 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.39 -30.13 66.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -61.43 -36.75 81.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.889 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.43 -58.88 3.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -44.22 61.45 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.026 0.441 . . . . 0.0 110.014 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.62 -40.92 98.49 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.306 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 57.2 tttm -66.96 -35.32 79.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.173 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.66 -49.99 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.446 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.27 69.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.798 0.809 . . . . 0.0 111.582 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -63.84 -37.52 87.68 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.027 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.55 -26.9 72.2 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 . . . . . 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.612 -179.624 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 CA--C 1.533 0.309 0 CA-C-O 120.77 0.319 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.539 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.5 t -51.69 -54.2 42.41 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 7.9 Cg_endo -46.99 -16.65 0.32 Allowed 'Trans proline' 0 C--N 1.306 -1.698 0 C-N-CA 122.045 1.83 . . . . 0.0 112.099 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -70.65 -47.13 61.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.114 0.483 . . . . 0.0 110.691 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.466 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.0 m-85 -62.97 -42.51 99.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.465 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 93.9 mt -65.43 -43.62 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.467 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -51.37 -26.27 7.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.436 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -72.95 -36.63 67.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.123 0.487 . . . . 0.0 110.597 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.41 -38.88 85.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.452 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.34 -37.0 74.27 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.105 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' MET . 59.2 tt0 -65.71 -30.27 70.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.651 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -68.63 -52.75 27.98 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.68 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.54 -44.59 53.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 0.0 110.965 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -67.79 -39.45 84.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.216 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.412 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 6.0 ttm -111.66 -163.21 0.84 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.529 0.68 . . . . 0.0 110.247 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -156.79 46.29 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.267 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -58.2 -49.46 76.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.176 0.512 . . . . 0.0 110.387 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -176.21 69.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -165.45 -133.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.272 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -157.0 -165.38 1.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.246 0.546 . . . . 0.0 110.124 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -81.37 -108.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.258 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' A' ' 29' ' ' ALA . 5.8 tp -63.87 -35.71 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -63.53 5.83 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.577 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.1 -43.15 54.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.5 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -62.6 -44.27 96.73 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.737 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' A' ' 30' ' ' MET . 29.9 m120 -52.49 -54.8 27.63 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.648 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.0 m -62.05 -55.25 31.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.466 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 55.1 t80 -57.23 -41.0 78.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.187 0.518 . . . . 0.0 110.596 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.517 ' N ' ' O ' ' A' ' 30' ' ' MET . 26.2 t80 -63.67 -52.37 60.99 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.989 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.505 HH12 ' CE ' ' B' ' 30' ' ' MET . 82.4 mtp180 -65.86 -27.14 68.01 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.608 ' HG ' ' N ' ' A' ' 37' ' ' VAL . 68.2 p -72.0 -44.25 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.74 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.608 ' N ' ' HG ' ' A' ' 36' ' ' SER . 17.1 t -66.87 -63.11 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.763 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.437 ' CG2' ' N ' ' A' ' 39' ' ' SER . 22.8 m -49.13 -45.84 17.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.338 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.437 ' N ' ' CG2' ' A' ' 38' ' ' VAL . 64.7 p -58.42 -43.62 88.76 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.202 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.485 ' O ' ' N ' ' A' ' 44' ' ' ASP . 97.0 m -65.49 -46.84 78.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 110.65 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.65 -43.49 96.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.579 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.1 t -85.7 29.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.357 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -160.68 -14.27 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.7 0.286 . . . . 0.0 110.796 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' THR . 31.4 t70 -114.37 -34.4 5.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.415 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -96.08 -79.59 0.44 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.543 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.4 mt 52.49 43.27 31.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.977 0.418 . . . . 0.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -88.65 -26.42 21.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.519 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -172.51 134.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.904 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 91.6 m-20 -54.72 -41.32 70.19 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.47 87.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.016 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.08 -43.59 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.523 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 56' ' ' ILE . 34.1 m -76.5 -36.85 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.406 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -59.94 -54.74 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.857 -177.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -38.71 92.01 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.428 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -65.49 -42.1 92.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.496 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 52' ' ' VAL . 71.3 mt -65.47 -45.79 91.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.497 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -54.63 -36.5 64.59 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.439 ' ND1' ' OE2' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -66.47 -35.53 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -40.24 95.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.522 -177.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -50.21 -29.88 10.36 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE2' ' ND1' ' A' ' 58' ' ' HIS . 4.9 pt-20 -60.34 -34.4 73.79 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.418 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.74 -49.26 26.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.954 0.407 . . . . 0.0 110.738 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.86 -38.44 64.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.909 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -69.32 -36.86 77.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.62 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -60.19 -39.27 85.92 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.227 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.83 -47.32 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 122.041 0.924 . . . . 0.0 110.414 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -61.46 -41.42 97.2 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.47 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 55.9 ttt85 -67.53 -14.21 62.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.108 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.59 -63.01 1.12 Allowed Glycine 0 N--CA 1.461 0.363 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.402 ' OE2' ' CD1' ' A' ' 27' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 120.506 0.193 . . . . 0.0 110.742 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.559 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.4 OUTLIER -64.93 -42.53 63.18 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 70.9 Cg_exo -51.95 -22.25 13.88 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 121.896 1.73 . . . . 0.0 111.984 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -61.91 -42.39 99.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.464 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -64.4 -38.12 89.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.192 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.9 mt -64.23 -44.88 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -49.89 -22.54 1.54 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.573 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -69.7 -40.03 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.328 0.585 . . . . 0.0 110.553 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.04 -36.11 66.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -58.11 -32.83 68.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' B' ' 20' ' ' MET . 57.4 tt0 -75.13 -30.05 60.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.457 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -67.09 -51.44 54.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 0.0 110.661 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.93 -41.82 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.497 0.665 . . . . 0.0 110.757 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -73.68 -51.72 15.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.661 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.438 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.0 tpp -90.2 -66.57 0.91 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.11 0.481 . . . . 0.0 110.583 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 t30 76.71 43.07 0.14 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.797 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -55.25 -35.95 65.53 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.332 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 90.8 p -163.45 63.57 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.651 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -161.15 -132.82 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.39 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -153.21 -170.31 3.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.342 0.591 . . . . 0.0 110.316 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -80.96 -108.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.442 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 21.0 tt -62.22 -38.47 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.34 -179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -58.48 -12.44 3.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.541 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.12 -41.62 49.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.522 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.559 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -65.38 -51.52 59.82 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.251 179.083 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.537 ' N ' ' SD ' ' B' ' 30' ' ' MET . 42.4 t30 -53.33 -37.28 62.16 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.243 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 79.5 p -76.73 -52.36 9.74 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.026 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.464 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 85.0 t80 -65.84 -38.16 88.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.398 0.618 . . . . 0.0 110.921 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.559 ' N ' ' O ' ' B' ' 30' ' ' MET . 58.6 t80 -62.08 -56.63 16.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.423 -179.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -60.47 -25.52 66.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.16 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.19 -45.88 53.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.726 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -67.45 -64.76 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.362 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.402 ' CG2' ' N ' ' B' ' 39' ' ' SER . 19.4 m -45.41 -41.32 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.474 -179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.402 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 14.0 t -60.26 -42.08 94.58 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -67.27 -46.12 74.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.797 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.4 mm? -59.84 -37.0 78.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.215 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.1 t -80.77 -38.14 16.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.365 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.38 -11.69 7.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.431 ' O ' ' O ' ' B' ' 41' ' ' LEU . 79.2 m-20 -143.55 161.79 37.55 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 121.318 0.58 . . . . 0.0 110.229 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 73.47 162.19 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.997 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 178.26 25.02 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -63.02 -32.07 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.113 0.482 . . . . 0.0 110.404 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -170.67 123.73 0.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.786 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.627 HD21 ' N ' ' B' ' 50' ' ' ALA . 0.5 OUTLIER -47.26 -29.71 2.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.437 179.447 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.627 ' N ' HD21 ' B' ' 49' ' ' ASN . . . -73.8 -47.04 41.6 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.19 0.519 . . . . 0.0 110.694 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.1 t -50.22 -42.68 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.304 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.3 m -76.14 -33.47 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.11 -40.85 98.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.43 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 36.8 pttt -53.0 -39.01 62.79 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -66.53 -40.75 89.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.132 -179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.72 -50.94 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.297 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -57.88 -39.21 77.28 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.43 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 6.1 m-70 -74.03 -38.13 64.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.109 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 tp -56.07 -30.59 62.2 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.582 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.468 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 91.9 m-20 -52.47 -28.5 20.5 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.495 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -62.1 -35.27 78.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.799 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.01 -53.29 13.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.688 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -45.82 72.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.018 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 75.6 m-20 -63.45 -36.27 83.18 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.002 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . 0.505 ' HZ2' HH21 ' B' ' 68' ' ' ARG . 34.5 tptt -61.37 -37.8 84.68 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.56 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.9 t -60.5 -58.22 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.284 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -62.13 -47.04 86.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.66 0.743 . . . . 0.0 111.636 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . 0.505 HH21 ' HZ2' ' B' ' 65' ' ' LYS . 55.5 ttp180 -56.03 -15.89 4.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.08 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.81 -16.33 36.55 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 . . . . . 0 N--CA 1.467 0.391 0 CA-C-O 120.656 0.265 . . . . 0.0 110.54 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.644 ' HG ' ' H ' ' A' ' 7' ' ' VAL . 30.7 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 110.561 -0.163 . . . . 0.0 110.561 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.644 ' H ' ' HG ' ' A' ' 6' ' ' SER . 3.0 t -58.79 -55.17 48.88 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-O 118.814 -0.612 . . . . 0.0 109.787 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 71.6 Cg_exo -34.04 -31.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.843 0 C-N-CA 121.633 1.555 . . . . 0.0 113.092 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 7' ' ' VAL . 53.3 t80 -63.65 -43.97 95.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.589 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.457 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.4 m-85 -61.59 -43.16 99.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.143 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -64.91 -49.01 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.418 0.628 . . . . 0.0 110.668 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -50.69 -25.11 3.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.401 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -73.65 -38.37 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.03 0.443 . . . . 0.0 110.258 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.5 mt -63.26 -39.43 94.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.435 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -59.89 -39.61 85.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.101 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -59.08 -26.8 64.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.531 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -73.97 -52.71 11.95 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.113 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -74.18 -43.66 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.222 0.534 . . . . 0.0 110.706 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 67.5 mm-40 -67.33 -48.18 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.355 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 5.8 ttm -96.79 -161.03 0.84 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.373 0.606 . . . . 0.0 109.939 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -157.46 36.68 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.238 -179.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -53.22 -66.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.997 0.427 . . . . 0.0 110.437 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.1 m -163.59 69.6 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.521 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -159.94 -137.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.49 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -154.97 -168.67 2.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.262 0.553 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -81.21 -105.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.335 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.553 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.6 tt -65.29 -35.93 76.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.455 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.689 ' NE2' HD21 ' A' ' 31' ' ' ASN . 49.3 t-80 -65.44 8.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.749 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -74.43 -43.88 54.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.59 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.3 -44.5 94.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.286 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.689 HD21 ' NE2' ' A' ' 28' ' ' HIS . 42.4 t30 -52.05 -51.34 58.16 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.955 -0.698 . . . . 0.0 110.676 -178.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.0 t -65.16 -54.18 33.67 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.068 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.457 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 54.1 t80 -59.29 -43.64 92.54 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.322 0.582 . . . . 0.0 110.729 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 30' ' ' MET . 34.4 t80 -59.57 -56.79 17.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.175 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.608 ' NH2' ' CE2' ' B' ' 63' ' ' TYR . 72.8 ttt-85 -61.17 -28.34 69.06 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.166 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 69.2 m -68.69 -44.71 73.4 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.428 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.4 t -70.89 -55.71 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.285 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -52.93 -45.93 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.382 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.2 m -64.82 -21.86 66.87 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.383 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -86.29 -49.85 7.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.342 0.591 . . . . 0.0 111.018 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.407 ' C ' ' H ' ' A' ' 43' ' ' GLN . 86.5 mt -66.17 -43.58 86.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.8 t -81.04 24.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.52 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' A' ' 41' ' ' LEU . 51.0 tt0 -140.53 1.06 1.71 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.445 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 46' ' ' LEU . 44.9 t0 -146.97 167.33 24.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.318 0.58 . . . . 0.0 110.266 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 65.96 -64.4 0.2 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.55 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 44' ' ' ASP . 18.9 mt 37.66 50.19 1.14 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.193 0.52 . . . . 0.0 111.05 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -78.28 -30.45 48.49 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.694 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -174.2 132.76 0.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.365 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.658 ' H ' HD21 ' A' ' 49' ' ' ASN . 0.8 OUTLIER -50.26 -41.17 49.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.375 0.607 . . . . 0.0 110.833 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.83 -47.58 82.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.683 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 48.2 t -58.56 -47.42 88.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.269 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.0 t -67.89 -42.48 85.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.36 0.6 . . . . 0.0 110.627 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.9 tp -60.17 -43.14 96.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.399 -178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.77 -38.04 60.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.172 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.4 mtp180 -67.44 -41.44 84.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.243 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 33.7 mm -62.96 -51.1 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.478 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -54.98 -43.84 73.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.673 0.273 . . . . 0.0 110.382 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -68.56 -35.25 77.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.249 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.19 -39.78 76.08 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.281 -179.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -51.19 -26.88 7.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.886 0.374 . . . . 0.0 110.387 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.41 -38.03 88.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.8 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -53.39 11.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.911 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.01 -42.21 48.81 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.42 0.628 . . . . 0.0 109.935 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -63.95 -30.67 71.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.216 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -63.69 -36.86 85.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.488 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 66.5 t -66.17 -43.92 91.8 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-O 121.933 0.873 . . . . 0.0 110.579 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -63.12 -44.95 94.18 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.109 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -72.14 -12.33 61.14 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.048 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -93.73 -33.28 7.14 Favored Glycine 0 N--CA 1.475 1.299 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 110.359 -179.576 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 CA--C 1.522 -0.103 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.533 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 38.3 t -65.8 -40.89 43.14 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.026 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 71.4 Cg_exo -50.23 -13.26 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 120.821 1.014 . . . . 0.0 112.198 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -73.11 -41.03 64.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 110.59 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.435 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -73.21 -46.72 48.81 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.542 -179.809 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.82 -45.86 97.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.647 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -50.19 -20.97 1.15 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.257 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -66.91 -36.53 82.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 0.0 110.519 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -74.18 -35.94 64.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.621 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.38 -40.54 68.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.44 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.3 tt0 -65.44 -35.29 80.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.253 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -63.19 -51.84 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.8 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -73.83 -45.81 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.106 0.479 . . . . 0.0 110.747 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -67.09 -51.06 59.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.355 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.431 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.1 tpp -91.59 -156.28 0.45 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.5 0.667 . . . . 0.0 110.004 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -164.74 41.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.202 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -57.33 -39.34 75.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.592 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t 174.45 70.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.54 -136.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.44 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -157.16 -159.91 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 110.39 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.415 ' HZ1' ' CD1' ' B' ' 27' ' ' ILE . 63.2 tttm -91.0 -104.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.291 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.527 ' C ' ' H ' ' B' ' 29' ' ' ALA . 39.0 mm -62.47 -41.37 91.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.287 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' B' ' 28' ' ' HIS . 61.4 t-80 -62.08 2.18 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.693 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.527 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.52 -46.53 54.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.61 0.243 . . . . 0.0 110.663 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.496 ' CE ' ' ND2' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -60.13 -42.64 95.26 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.174 179.494 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' CE ' ' B' ' 30' ' ' MET . 30.7 m120 -52.02 -50.84 60.6 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.788 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 72.1 m -66.52 -56.16 12.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.962 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.435 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 80.7 t80 -56.58 -46.23 80.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.053 0.454 . . . . 0.0 110.605 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' B' ' 30' ' ' MET . 79.5 t80 -57.87 -47.32 83.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.986 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 74.7 ttt-85 -71.16 -24.88 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.337 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 36.4 p -72.59 -47.83 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.46 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.78 -56.95 9.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.591 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -48.98 -45.54 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 69.3 m -60.7 -34.82 74.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.771 0.319 . . . . 0.0 110.304 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.8 m -74.15 -47.84 33.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.196 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.5 -36.12 66.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.21 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -81.55 -31.79 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.294 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -124.12 82.73 2.06 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.549 0.69 . . . . 0.0 110.016 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -170.94 -67.03 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.944 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -102.06 -45.51 5.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.933 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 12.2 mt 44.04 60.82 2.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -92.84 -26.58 17.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.367 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.51 138.41 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.65 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -55.73 -43.1 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.162 0.506 . . . . 0.0 110.549 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.39 -43.06 97.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.92 -35.52 65.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.069 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 49.0 t -78.2 -44.44 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.425 0.631 . . . . 0.0 111.028 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.86 -51.99 66.97 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.857 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptmm? -57.08 -39.88 75.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.264 0.554 . . . . 0.0 110.214 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.36 -37.88 88.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.336 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.8 mt -66.91 -46.53 84.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.37 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.87 -37.44 68.81 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.532 ' HE2' ' CG1' ' B' ' 7' ' ' VAL . 1.4 t-80 -73.31 -37.35 66.2 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.92 -39.96 96.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.78 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.403 ' O ' ' OD1' ' B' ' 64' ' ' ASN . 50.0 m-20 -50.43 -29.72 10.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.443 ' OE1' ' CD2' ' B' ' 58' ' ' HIS . 3.3 pt-20 -59.86 -33.07 71.31 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.669 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.24 -51.19 26.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.61 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.608 ' CE2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -53.34 -44.13 68.23 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.108 0.48 . . . . 0.0 109.766 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' B' ' 60' ' ' ASP . 22.6 m120 -64.48 -32.44 74.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.1 tptp -60.39 -37.01 79.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.587 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.78 -46.29 94.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.724 0.773 . . . . 0.0 110.318 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.15 -47.19 52.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 122.183 0.992 . . . . 0.0 111.901 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -60.51 -26.1 66.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.139 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.22 -63.7 1.57 Allowed Glycine 0 C--N 1.33 0.213 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.719 0.295 . . . . 0.0 110.506 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.295 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.599 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 t -72.5 -38.18 5.02 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.13 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 41.0 Cg_exo -56.35 -22.35 41.08 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 121.565 1.51 . . . . 0.0 111.892 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -60.64 -48.15 83.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.828 0.347 . . . . 0.0 110.285 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.0 m-85 -57.75 -37.37 73.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.087 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -67.94 -44.11 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.006 0.431 . . . . 0.0 110.526 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -51.95 -26.41 10.39 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -72.16 -30.92 65.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.968 0.413 . . . . 0.0 110.21 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 mt -68.83 -38.89 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.701 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.32 -34.13 73.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.091 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -66.33 -29.36 69.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.595 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 47.6 m170 -71.43 -53.52 13.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.78 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.91 -39.45 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.755 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.28 -55.62 31.49 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.809 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.442 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 69.0 mtm -107.51 -62.77 1.38 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.952 0.406 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 8.2 t30 83.56 51.56 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.795 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -48.19 -41.93 28.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.513 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -160.83 65.87 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.593 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' C ' HD22 ' A' ' 21' ' ' ASN . 20.2 tp10 -158.72 -134.73 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.418 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 73.4 m-20 -148.14 -166.22 2.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.188 0.518 . . . . 0.0 110.363 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -86.09 -110.03 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.428 ' C ' ' H ' ' A' ' 29' ' ' ALA . 17.9 tt -61.29 -33.63 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 120.797 0.332 . . . . 0.0 110.351 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.715 ' NE2' HD21 ' A' ' 31' ' ' ASN . 46.4 t-80 -67.42 2.05 1.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -66.59 -45.48 79.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.562 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -63.15 -43.86 97.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.89 179.82 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.715 HD21 ' NE2' ' A' ' 28' ' ' HIS . 43.8 t30 -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.609 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -66.2 -53.57 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.86 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.422 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 64.1 t80 -61.0 -46.34 91.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.614 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 33.8 t80 -58.77 -42.36 88.77 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.487 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -67.4 -31.21 71.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 0.0 110.199 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.9 t -70.94 -42.69 69.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.1 t -67.32 -61.22 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.479 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.8 p -47.94 -40.88 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.074 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.6 m -54.0 -47.49 71.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 96.3 m -83.67 -32.49 25.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.664 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.35 -45.01 80.61 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.149 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.8 t -68.48 -4.92 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.189 0.518 . . . . 0.0 110.529 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -113.94 -39.89 3.86 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.802 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -46.83 -47.86 21.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.337 0.589 . . . . 0.0 110.097 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -103.15 -91.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.276 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 73.2 35.04 0.96 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.986 0.422 . . . . 0.0 110.191 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 t -98.24 -23.84 15.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.735 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -167.04 131.65 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.753 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -52.24 -34.72 47.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.285 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.03 -48.64 57.13 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.944 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -50.82 -42.75 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.693 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -76.28 -31.98 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.612 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.35 -47.56 83.66 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.673 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' CE1' ' A' ' 58' ' ' HIS . 2.1 ptpp? -63.36 -40.92 98.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.393 0.616 . . . . 0.0 110.157 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -65.29 -43.58 90.71 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.27 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.63 -44.47 99.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -55.09 -31.23 61.05 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.435 ' CE1' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -71.9 -36.5 70.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 tp -73.56 -29.09 62.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.471 ' O ' ' CD2' ' A' ' 63' ' ' TYR . 90.8 m-20 -52.53 -38.91 60.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.993 0.425 . . . . 0.0 110.322 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -66.84 -18.7 65.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.486 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.13 -61.69 1.8 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.019 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.605 ' CD1' ' NH2' ' B' ' 35' ' ' ARG . 1.0 OUTLIER -56.01 -40.41 73.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.884 0.85 . . . . 0.0 110.154 -179.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.468 ' N ' ' CG ' ' A' ' 63' ' ' TYR . 52.2 t30 -62.83 -40.27 96.9 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.468 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -58.16 -42.68 86.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.2 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.482 ' O ' ' N ' ' A' ' 70' ' ' GLU . 72.7 t -62.88 -55.65 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.207 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -63.15 -43.05 99.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.513 0.673 . . . . 0.0 111.336 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -66.79 -18.89 65.6 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.11 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 70' ' ' GLU . . . -107.86 -13.11 20.93 Favored Glycine 0 N--CA 1.464 0.554 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 66' ' ' VAL . 4.2 mm-40 . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 121.183 0.516 . . . . 0.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 110.893 -0.04 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 3.2 t -55.24 -54.97 44.62 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 118.903 -0.57 . . . . 0.0 109.808 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 52.3 Cg_exo -34.3 -27.5 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.009 0 C-N-CA 121.7 1.6 . . . . 0.0 113.124 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 7' ' ' VAL . 57.5 t80 -58.35 -37.77 75.84 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.304 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.44 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -61.78 -43.18 99.36 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.5 -46.95 82.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.84 0.828 . . . . 0.0 110.738 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -49.32 -23.14 1.29 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.63 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . 0.414 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 18.5 m120 -74.93 -36.09 62.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.517 0.675 . . . . 0.0 110.595 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.4 mt -69.13 -38.51 78.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.34 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -54.15 -39.98 67.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.165 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.0 tt0 -70.71 -31.81 68.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.238 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.469 ' O ' ' ND2' ' B' ' 21' ' ' ASN . 43.2 m170 -66.74 -50.41 62.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.704 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.3 pt -72.93 -36.16 50.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.329 0.585 . . . . 0.0 110.656 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -77.39 -54.65 6.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.069 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.446 ' N ' ' O ' ' B' ' 16' ' ' GLN . 18.8 tpp -81.77 -58.65 2.9 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.257 0.551 . . . . 0.0 110.54 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 17' ' ' HIS . 3.1 m120 69.5 36.76 2.13 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.866 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -60.28 -38.65 84.23 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.276 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.1 m -152.22 60.07 0.84 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.742 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -166.7 -133.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.139 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -158.44 -168.58 2.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.407 0.623 . . . . 0.0 110.358 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -85.8 -104.23 0.06 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.277 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.498 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.4 mm -61.31 -37.34 77.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -64.42 3.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.882 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.498 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.78 -46.81 51.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.828 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.41 ' HG3' ' H ' ' B' ' 31' ' ' ASN . 1.0 OUTLIER -62.5 -50.84 69.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.948 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.41 ' H ' ' HG3' ' B' ' 30' ' ' MET . 89.5 m-20 -58.75 -48.04 82.57 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.447 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -65.34 -53.79 38.54 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.546 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.44 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 39.5 t80 -60.11 -53.14 61.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.078 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.407 ' CB ' ' O ' ' B' ' 30' ' ' MET . 55.1 t80 -53.44 -42.06 66.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.605 ' NH2' ' CD1' ' A' ' 63' ' ' TYR . 73.0 ttt-85 -68.55 -35.17 77.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.2 t -64.6 -43.0 95.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.486 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' B' ' 41' ' ' LEU . 62.2 t -67.1 -65.35 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.421 ' CG2' ' N ' ' B' ' 39' ' ' SER . 29.9 m -47.64 -49.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.7 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.421 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 34.2 p -47.48 -61.09 2.09 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 119.994 -0.682 . . . . 0.0 111.401 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.418 ' H ' ' HG ' ' B' ' 39' ' ' SER . 97.6 m -74.62 -44.18 51.84 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.273 1.035 . . . . 0.0 111.03 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.566 ' N ' ' O ' ' B' ' 37' ' ' VAL . 51.3 tp -57.31 -34.44 68.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.579 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . 0.417 ' CG2' ' O ' ' B' ' 38' ' ' VAL . 53.6 t -75.65 -2.28 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.9 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -155.58 41.04 0.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.401 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -99.12 -59.45 1.72 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.101 0.477 . . . . 0.0 110.389 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -113.19 -31.97 6.45 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.528 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 tt 48.79 68.02 0.77 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.257 0.551 . . . . 0.0 110.163 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.2 t -96.49 -25.34 15.69 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.298 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -180.0 140.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.688 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -61.97 -44.77 96.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.76 86.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 9.0 t -57.93 -62.04 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.704 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 25.5 m -54.03 -33.82 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.434 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -61.72 2.21 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.048 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.32 -34.67 64.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.206 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -65.34 -39.57 92.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 86.5 mt -67.65 -49.97 65.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.335 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -56.52 -38.28 71.63 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.479 ' CE1' ' OE1' ' B' ' 61' ' ' GLU . 34.0 t60 -69.78 -43.29 72.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.32 -27.5 47.49 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.488 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -53.29 -36.71 61.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.435 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.479 ' OE1' ' CE1' ' B' ' 58' ' ' HIS . 5.8 pt-20 -57.72 -31.27 66.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.387 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.43 -58.13 4.05 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.79 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.3 -40.71 49.37 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.032 0.444 . . . . 0.0 109.933 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -68.98 -36.62 78.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.578 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -65.05 -35.77 82.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.616 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 77.6 t -57.24 -52.92 50.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.09 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -69.69 -38.4 76.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.012 0.911 . . . . 0.0 111.664 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -40.85 -32.84 0.25 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.394 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.93 -44.76 5.91 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.056 0.455 . . . . 0.0 110.035 -179.486 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.585 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.9 t -65.84 -40.47 39.32 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.124 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 49.9 Cg_exo -54.19 -26.61 43.19 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 121.79 1.66 . . . . 0.0 112.066 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.19 -41.05 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.281 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.456 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.6 m-85 -60.38 -39.39 87.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.364 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.412 ' O ' ' N ' ' A' ' 14' ' ' LEU . 55.3 mt -67.79 -45.27 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.979 0.419 . . . . 0.0 110.461 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -48.2 -23.99 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.529 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -74.48 -33.79 62.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 110.685 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 11' ' ' ILE . 21.9 mt -72.58 -37.51 68.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.314 -179.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -57.26 -41.08 79.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.993 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.504 HE21 HE21 ' A' ' 22' ' ' GLN . 56.4 tt0 -67.95 -31.29 70.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.543 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -66.17 -50.69 63.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.819 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 pt -70.92 -39.94 75.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.25 0.548 . . . . 0.0 110.83 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -57.59 -53.86 53.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.252 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 72.8 mtm -114.49 -118.82 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.404 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -171.67 61.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.377 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.504 HE21 HE21 ' A' ' 16' ' ' GLN . 8.1 tp-100 -73.41 50.35 0.31 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 122.105 0.955 . . . . 0.0 110.96 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 76.79 55.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.136 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -156.51 -134.68 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.21 0.528 . . . . 0.0 110.614 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -159.38 -169.29 2.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.21 -179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.7 tttm -80.71 -105.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.356 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.488 ' C ' ' H ' ' A' ' 29' ' ' ALA . 6.9 tt -65.71 -31.12 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.53 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -69.86 10.33 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.557 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.56 -45.18 22.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.358 0.599 . . . . 0.0 110.872 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.55 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.9 ptm -62.01 -50.76 70.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.401 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.421 ' H ' ' HG3' ' A' ' 30' ' ' MET . 47.7 t30 -53.61 -46.91 70.59 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.397 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -67.05 -53.6 29.59 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.055 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.456 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 47.4 t80 -62.4 -49.63 74.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.385 0.612 . . . . 0.0 110.99 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.55 ' N ' ' O ' ' A' ' 30' ' ' MET . 75.9 t80 -54.56 -47.94 72.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.07 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -65.25 -38.1 89.29 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 33' ' ' TYR . 33.4 p -59.89 -43.41 94.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.401 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 98.0 t -70.89 -49.55 49.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.468 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.6 -49.25 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.396 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.8 t -59.02 -35.92 74.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.817 0.341 . . . . 0.0 110.452 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 90.1 m -71.66 -49.77 36.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.412 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -49.74 -34.26 18.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -86.21 -33.48 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.5 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 44' ' ' ASP . 84.3 mt-30 -111.33 81.63 1.47 Allowed 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.989 0.9 . . . . 0.0 109.736 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.458 ' CB ' ' O ' ' A' ' 43' ' ' GLN . 3.6 t70 156.94 136.44 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.204 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.408 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 56.4 tt0 69.21 -62.23 0.41 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt 45.56 70.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.058 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -101.25 -28.9 12.39 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.302 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.416 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 34.5 ttpt -178.17 144.83 0.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.232 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.91 -41.96 97.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.416 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -58.37 -46.18 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.982 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.4 -64.86 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.74 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 31.9 m -53.8 -39.69 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.602 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.4 tp -60.43 -52.27 65.94 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.733 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 49.5 mtpt -52.07 -37.02 52.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.568 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -66.48 -34.28 77.59 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.181 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.7 mt -71.81 -52.77 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.779 -0.369 . . . . 0.0 110.354 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.76 -32.98 69.77 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.141 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.4 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -77.12 -46.91 21.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.6 tp -52.23 -27.16 13.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.44 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -51.26 -38.35 52.21 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.397 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -54.71 -33.02 60.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.588 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.49 16.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.549 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.461 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.29 -44.81 68.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.141 0.496 . . . . 0.0 110.318 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -65.83 -35.56 81.02 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.961 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.32 -40.01 94.93 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.416 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.65 -48.81 86.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.455 0.645 . . . . 0.0 110.467 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -44.14 92.38 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.414 1.102 . . . . 0.0 111.698 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -55.77 -27.67 52.15 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.63 -8.5 84.58 Favored Glycine 0 CA--C 1.518 0.262 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 61.6 mm-40 . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 43.7 t . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 120.938 0.399 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.473 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.7 t -57.4 -54.92 49.8 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.148 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 50.2 Cg_exo -35.06 -29.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.117 1.878 . . . . 0.0 113.081 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . 0.472 ' N ' ' O ' ' B' ' 7' ' ' VAL . 41.0 t80 -56.22 -41.85 76.3 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.018 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.8 m-85 -62.11 -40.23 95.18 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 36.3 mt -64.86 -48.78 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 121.295 0.569 . . . . 0.0 110.343 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.85 -26.49 35.71 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.311 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . 0.451 ' ND2' ' O ' ' B' ' 9' ' ' TYR . 4.5 m120 -69.49 -35.57 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.872 0.368 . . . . 0.0 110.235 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.3 -36.92 80.08 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.635 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -56.42 -32.54 64.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.033 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' B' ' 20' ' ' MET . 1.9 pt20 -67.25 -35.06 78.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.378 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -65.33 -50.74 64.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.505 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.8 pt -73.36 -41.73 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.564 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -72.07 -53.77 11.86 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.428 ' N ' ' O ' ' B' ' 16' ' ' GLN . 24.8 ttm -86.47 -69.06 0.7 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.106 0.479 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' B' ' 25' ' ' ASP . 43.2 t30 74.93 45.03 0.16 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.706 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -40.04 -34.35 0.28 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.461 0.648 . . . . 0.0 111.097 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.1 p -167.09 -20.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.659 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -61.42 -132.52 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.917 0.389 . . . . 0.0 110.593 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 69.1 m-20 -155.79 -166.29 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.351 0.596 . . . . 0.0 110.099 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.41 -101.81 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.793 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.581 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.7 mm -65.66 -39.69 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.186 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . 0.629 ' ND1' HD21 ' B' ' 31' ' ' ASN . 73.2 t60 -65.64 11.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.278 . . . . 0.0 110.508 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.581 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.92 -49.25 18.35 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.938 0.399 . . . . 0.0 110.475 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.594 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -58.01 -39.93 79.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.258 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.629 HD21 ' ND1' ' B' ' 28' ' ' HIS . 93.2 m-20 -49.75 -40.4 40.91 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.415 ' O ' ' OG ' ' B' ' 36' ' ' SER . 22.3 t -80.12 -55.92 4.59 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.619 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 63.4 t80 -58.18 -46.6 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.085 0.469 . . . . 0.0 110.887 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.594 ' N ' ' O ' ' B' ' 30' ' ' MET . 28.9 t80 -57.22 -51.52 68.99 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.897 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 74.9 ttt180 -67.08 -25.94 66.48 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' B' ' 32' ' ' SER . 48.7 m -70.9 -46.95 61.64 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.566 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' B' ' 40' ' ' THR . 77.8 t -64.95 -65.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.63 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.43 ' CG2' ' N ' ' B' ' 39' ' ' SER . 23.6 m -45.69 -46.23 4.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.537 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.43 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 42.0 t -59.67 -26.58 65.66 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.458 ' O ' ' N ' ' B' ' 44' ' ' ASP . 28.9 m -85.22 -51.12 6.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.779 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.88 -45.05 91.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.78 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.7 t -58.23 -22.1 18.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.078 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -103.8 -26.79 12.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.577 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' B' ' 40' ' ' THR . 51.3 t0 -56.74 -47.4 80.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.207 0.527 . . . . 0.0 110.766 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -133.38 -167.09 1.87 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.313 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 179.1 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.578 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.49 92.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.264 0.554 . . . . 0.0 110.284 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -156.89 133.0 9.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -50.24 -25.3 3.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.617 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.478 ' C ' ' HZ1' ' B' ' 54' ' ' LYS . . . -78.16 -53.4 7.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.075 0.464 . . . . 0.0 110.948 179.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 23.3 t -46.04 -39.52 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.286 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -77.05 -32.01 19.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.25 0.547 . . . . 0.0 110.599 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 tp -59.95 -29.83 68.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.259 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.478 ' HZ1' ' C ' ' B' ' 50' ' ' ALA . 28.5 mmtm -62.03 -46.7 88.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.453 0.644 . . . . 0.0 110.525 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -64.95 -42.74 94.36 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.399 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 78.4 mt -62.8 -50.1 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.451 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -54.33 -35.76 63.04 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 8.9 m-70 -72.36 -22.3 61.17 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -23.97 53.98 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.347 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.4 -41.67 98.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.452 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 58' ' ' HIS . 7.9 pt-20 -61.77 -31.47 71.67 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.947 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.93 -57.86 4.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.532 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -42.97 55.9 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 110.212 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -63.43 -33.72 76.17 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.765 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -64.4 -38.1 89.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.441 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.01 -48.33 89.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.464 0.65 . . . . 0.0 110.4 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -48.21 50.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.211 1.005 . . . . 0.0 111.692 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -59.46 -35.17 73.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.106 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.44 -16.56 75.68 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 121.047 0.451 . . . . 0.0 110.583 -179.893 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 121.055 0.455 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.616 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 57.2 t -65.04 -48.25 71.36 Favored Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 9.0 Cg_endo -47.34 -23.64 3.35 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 121.636 1.557 . . . . 0.0 112.296 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -62.32 -43.69 98.24 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.04 0.448 . . . . 0.0 110.491 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -61.4 -41.93 97.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.103 -179.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.4 mt -60.27 -44.2 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.288 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -52.12 -23.95 6.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.753 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -66.58 -38.4 86.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.51 -36.94 65.82 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.812 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptt -52.95 -32.99 48.97 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.143 0.497 . . . . 0.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.5 tt0 -68.95 -33.67 74.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.603 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -63.57 -51.86 63.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.616 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.401 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 9.0 pt -73.96 -45.48 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.291 0.567 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.1 tt0 -67.61 -38.87 84.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.263 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.422 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 5.7 ttm -111.04 -164.07 0.89 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.596 0.713 . . . . 0.0 110.253 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -154.83 45.36 0.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.36 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -56.55 -46.01 80.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.129 0.49 . . . . 0.0 110.408 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.4 ' O ' ' OG ' ' A' ' 23' ' ' SER . 4.0 t 176.81 67.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.397 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -161.35 -133.72 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 110.358 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -156.69 -168.67 2.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.185 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 60.9 tttp -80.34 -104.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.557 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.7 tt -64.86 -35.46 75.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.65 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -67.44 12.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.623 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.557 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -77.93 -45.73 23.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.118 0.485 . . . . 0.0 110.585 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -61.06 -43.94 98.12 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.526 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' A' ' 30' ' ' MET . 26.4 t-20 -50.25 -40.33 47.52 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.493 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -78.59 -55.42 5.21 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.755 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.464 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 78.8 t80 -59.49 -48.92 79.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.188 0.518 . . . . 0.0 110.681 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 30' ' ' MET . 64.7 t80 -54.56 -44.39 72.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.859 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -71.28 -28.02 63.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.9 m -70.03 -48.02 59.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.037 0.446 . . . . 0.0 110.711 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -71.26 -45.26 71.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.466 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.26 -42.48 66.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.29 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.5 p -64.5 -25.9 68.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.78 0.324 . . . . 0.0 110.498 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 94.4 m -84.21 -45.69 12.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.718 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.92 -43.06 91.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.867 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 p -70.79 -27.37 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 121.463 0.649 . . . . 0.0 110.931 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.529 ' O ' ' C ' ' A' ' 44' ' ' ASP . 66.4 mt-30 -86.04 -28.44 24.14 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.629 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.529 ' C ' ' O ' ' A' ' 43' ' ' GLN . 77.0 m-20 -24.96 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 47' ' ' THR . 10.4 pt20 -156.55 7.68 0.2 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.051 0.453 . . . . 0.0 110.627 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.477 ' C ' ' O ' ' A' ' 45' ' ' GLN . 1.0 OUTLIER 27.93 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.486 0.66 . . . . 0.0 111.075 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 45' ' ' GLN . 9.8 t -60.53 -29.92 69.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.588 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -157.99 126.31 5.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.58 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.401 ' CG ' ' ND2' ' B' ' 49' ' ' ASN . 17.1 p30 -46.74 -35.82 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.198 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.68 70.37 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.888 0.375 . . . . 0.0 110.697 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.56 -45.07 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.642 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.35 -41.16 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.114 0.483 . . . . 0.0 110.925 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.68 -48.52 74.44 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.052 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.42 -43.58 93.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.802 0.81 . . . . 0.0 110.411 -178.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.466 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 19.5 tpt85 -63.35 -37.03 85.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.129 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.25 -45.18 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.419 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.99 -36.62 72.89 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.381 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.6 m170 -72.63 -43.5 63.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.34 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -53.56 -30.43 41.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.748 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -51.77 -29.2 17.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -60.96 -32.51 72.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.3 -56.56 5.78 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.729 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -44.99 66.36 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.976 0.417 . . . . 0.0 110.121 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.74 -35.53 80.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.0 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -57.34 -42.78 82.61 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.457 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.8 -49.68 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 121.536 0.684 . . . . 0.0 110.484 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -43.38 92.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.82 0.819 . . . . 0.0 111.523 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.05 -23.3 63.63 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.109 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.41 -17.85 20.73 Favored Glycine 0 N--CA 1.465 0.597 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 5.8 mm-40 . . . . . 0 N--CA 1.465 0.323 0 CA-C-O 121.354 0.597 . . . . 0.0 110.323 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 120.98 0.419 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.594 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -55.77 -50.53 86.6 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.807 178.65 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.594 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 5.7 Cg_endo -44.62 -17.49 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.987 1.792 . . . . 0.0 112.217 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . 0.437 ' N ' ' O ' ' B' ' 7' ' ' VAL . 81.0 t80 -69.28 -43.01 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.154 0.502 . . . . 0.0 110.433 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -68.21 -46.09 71.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.659 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' B' ' 14' ' ' LEU . 40.6 mt -62.8 -43.61 98.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.086 0.47 . . . . 0.0 110.29 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -46.34 -21.96 0.21 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.205 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . 0.416 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 46.4 m-20 -73.03 -39.29 66.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.905 0.383 . . . . 0.0 110.363 179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.473 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 7.3 mp -71.13 -37.01 72.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.64 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -55.98 -42.31 76.1 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.323 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -66.92 -31.63 72.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.416 ' CD2' ' O ' ' B' ' 13' ' ' ASN . 45.1 m170 -66.98 -51.73 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.156 0.503 . . . . 0.0 110.672 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.1 pt -74.11 -43.69 51.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.833 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.7 -53.61 21.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 8.5 tpp -88.15 -157.87 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.5 0.666 . . . . 0.0 109.992 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -157.74 46.28 0.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.321 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -63.03 -51.98 64.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.252 0.549 . . . . 0.0 110.497 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.7 p -174.91 72.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -166.52 -136.2 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.991 0.424 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -157.44 -158.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 64.1 tttm -94.91 -103.01 0.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.431 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.438 ' C ' ' H ' ' B' ' 29' ' ' ALA . 1.6 mm -61.59 -36.71 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.114 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.64 4.86 2.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.613 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.438 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -73.98 -50.24 20.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.723 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.543 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -61.46 -43.52 98.73 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.253 179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.543 ' N ' ' SD ' ' B' ' 30' ' ' MET . 15.0 m120 -53.71 -48.46 69.55 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.587 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -66.91 -53.22 34.16 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.818 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 57.0 t80 -61.79 -50.06 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.26 0.553 . . . . 0.0 110.849 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.502 ' N ' ' O ' ' B' ' 30' ' ' MET . 75.1 t80 -54.71 -45.52 74.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.722 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -68.62 -37.0 79.4 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.617 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 55.2 m -61.96 -44.18 97.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.217 0.532 . . . . 0.0 110.772 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.7 t -72.05 -46.27 59.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.597 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.0 t -50.47 -44.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.351 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 10.7 t -63.39 -34.64 78.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.191 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -72.61 -49.92 28.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.143 0.497 . . . . 0.0 110.936 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.441 ' CD2' ' NH2' ' B' ' 55' ' ' ARG . 97.3 mt -50.91 -34.93 30.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.948 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.5 t -87.77 -32.81 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.441 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -119.72 82.58 1.91 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.527 0.68 . . . . 0.0 110.176 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -167.64 -71.22 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.998 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . 0.63 ' NE2' HH12 ' B' ' 55' ' ' ARG . 5.2 pt20 -105.54 -38.35 6.48 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.342 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 tp 37.85 54.19 1.56 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.787 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.5 t -83.89 -24.79 30.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -173.78 138.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.751 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.536 ' ND2' ' N ' ' B' ' 50' ' ' ALA . 2.1 p-10 -54.59 -46.15 73.71 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.808 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.536 ' N ' ' ND2' ' B' ' 49' ' ' ASN . . . -58.66 -45.7 88.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.432 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.67 -34.34 47.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.005 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 39.3 t -81.89 -45.07 20.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.591 0.71 . . . . 0.0 111.1 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -52.35 65.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.907 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.437 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.2 pttp -53.36 -40.58 65.06 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.63 HH12 ' NE2' ' B' ' 45' ' ' GLN . 77.3 mtp180 -68.34 -37.28 80.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.118 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 4.3 mm -64.38 -50.65 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.459 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -61.39 -37.22 82.61 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.255 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.496 ' CE1' ' OE2' ' B' ' 61' ' ' GLU . 5.7 t-80 -67.55 -46.98 71.16 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.888 0.375 . . . . 0.0 110.233 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.7 tp -49.88 -30.43 10.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.685 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -52.21 -30.83 29.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.7 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.496 ' OE2' ' CE1' ' B' ' 58' ' ' HIS . 9.5 pt-20 -58.1 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.602 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.43 -53.47 28.83 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.836 0.35 . . . . 0.0 110.475 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -46.28 72.04 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 110.193 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.476 ' ND2' ' CZ ' ' B' ' 68' ' ' ARG . 49.9 t30 -63.75 -36.67 84.65 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.315 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 30.5 tptt -60.26 -33.6 72.53 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.61 -43.15 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 122.028 0.918 . . . . 0.0 110.515 -178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.476 ' CB ' ' HZ1' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -69.0 -44.77 72.13 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.655 -179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . 0.476 ' CZ ' ' ND2' ' B' ' 64' ' ' ASN . 87.2 mtm180 -66.82 -21.93 66.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.336 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.69 -70.1 1.24 Allowed Glycine 0 N--CA 1.463 0.453 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' B' ' 26' ' ' LYS . 2.7 pp20? . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 121.686 0.755 . . . . 0.0 111.464 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.924 0.393 . . . . 0.0 110.18 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.577 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -67.66 -41.8 32.16 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.868 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 52.4 Cg_exo -52.85 -24.82 25.25 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.02 1.814 . . . . 0.0 111.92 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -61.62 -47.2 86.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.842 0.353 . . . . 0.0 110.331 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.503 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 2.9 m-85 -59.41 -40.47 86.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.293 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.9 mt -64.71 -43.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-O 121.032 0.444 . . . . 0.0 110.295 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -52.02 -25.76 9.23 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.735 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -73.21 -35.46 66.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.269 0.557 . . . . 0.0 110.621 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.0 mt -70.55 -37.37 74.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.323 -179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -52.28 -39.67 60.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.069 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.01 -31.86 73.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.586 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.32 -51.95 46.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.697 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.95 -44.32 57.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -53.94 -55.34 27.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.45 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 58.2 mtm -113.11 -133.34 0.34 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.921 0.391 . . . . 0.0 110.202 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p30 -171.48 52.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.332 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -45.08 74.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.491 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -174.56 62.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -166.17 -133.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.399 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -157.39 -162.95 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 110.325 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 64.2 tttm -83.44 -104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.356 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.576 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.8 mt -66.11 -37.42 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -63.69 6.47 0.15 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.612 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.576 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.16 -45.8 22.28 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.466 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.61 -44.85 95.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.479 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.573 ' N ' ' SD ' ' A' ' 30' ' ' MET . 39.2 t30 -51.63 -50.69 59.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.557 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.0 m -65.51 -53.38 43.15 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.633 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.503 ' OH ' ' CD1' ' A' ' 10' ' ' PHE . 4.9 t80 -61.46 -23.46 65.89 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.368 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 30' ' ' MET . 82.8 t80 -76.74 -57.61 3.76 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.376 0.608 . . . . 0.0 110.953 -178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -65.72 -23.81 66.84 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.979 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.63 ' HG ' ' H ' ' A' ' 37' ' ' VAL . 93.0 p -71.2 -49.88 38.91 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.541 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.63 ' H ' ' HG ' ' A' ' 36' ' ' SER . 79.8 t -70.8 -56.35 11.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.934 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.2 t -49.97 -48.04 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.501 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 35' ' ' ARG . 58.2 m -54.96 -52.29 63.5 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.798 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.0 m -68.92 -44.17 73.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.754 0.788 . . . . 0.0 110.981 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.72 -40.69 88.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.432 -178.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 26.5 t -96.0 26.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.106 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -165.9 27.77 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -154.54 17.48 0.46 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.705 0.288 . . . . 0.0 110.541 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -153.38 -77.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.359 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.8 tp 59.41 41.41 19.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 110.642 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.8 m -70.85 -40.49 72.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.51 0.671 . . . . 0.0 110.966 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -175.53 143.15 0.61 Allowed 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.627 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.421 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 65.7 m-20 -50.08 -45.93 52.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.724 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.91 82.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.706 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.457 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . 49.9 t -57.02 -47.23 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.863 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.417 ' CG2' ' N ' ' A' ' 53' ' ' LEU . 15.9 m -76.55 -46.65 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.66 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.421 ' CB ' ' O ' ' A' ' 49' ' ' ASN . 60.0 tp -51.3 -58.6 5.76 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.884 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.472 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 17.5 pttm -50.5 -35.63 30.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.851 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 tpt85 -66.34 -44.7 82.54 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.199 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 50.6 mm -63.57 -52.51 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.487 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -56.61 -39.4 73.54 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.472 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -68.99 -44.0 73.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.273 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 tp -60.2 -33.68 72.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.87 0.367 . . . . 0.0 110.434 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -51.4 -39.55 57.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.541 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.75 -29.16 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.11 -54.0 21.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.773 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.7 -43.06 72.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.158 0.504 . . . . 0.0 110.118 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -66.07 -37.37 85.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.621 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.5 mmpt? -62.0 -34.58 76.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.239 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.58 -46.04 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.363 0.602 . . . . 0.0 110.153 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -67.96 -42.84 80.27 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.497 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -80.67 -10.41 59.73 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.151 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -97.66 -26.12 10.15 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.472 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 1.5 pp20? . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 120.893 0.377 . . . . 0.0 110.329 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 46.6 t . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.588 0.232 . . . . 0.0 110.845 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.9 t -56.01 -55.59 39.84 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 46.6 Cg_exo -34.82 -26.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.052 1.835 . . . . 0.0 113.126 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 7' ' ' VAL . 89.8 t80 -56.65 -40.07 74.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.356 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.463 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -59.23 -45.39 91.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.072 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.57 -43.99 83.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.319 0.581 . . . . 0.0 110.384 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -50.59 -25.86 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.507 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -76.08 -34.54 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.246 0.546 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.8 mt -73.25 -40.03 64.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.537 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.42 -37.11 74.69 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.997 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.447 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.4 tt0 -66.59 -41.43 88.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -59.08 -49.55 77.45 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.858 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.8 pt -73.31 -40.67 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.618 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -72.06 -60.42 2.24 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.144 -0.623 . . . . 0.0 110.964 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.53 ' SD ' ' N ' ' B' ' 20' ' ' MET . 0.0 OUTLIER -81.43 -66.29 0.91 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.719 HD22 ' N ' ' B' ' 25' ' ' ASP . 7.2 t-20 75.46 46.84 0.11 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -54.32 -41.35 68.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.008 0.432 . . . . 0.0 110.583 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 38.2 t -161.63 66.09 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.601 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . 0.443 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 29.2 tp10 -158.03 -127.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.394 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . 0.719 ' N ' HD22 ' B' ' 21' ' ' ASN . 62.3 m-20 -160.68 -172.41 3.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.239 0.543 . . . . 0.0 110.109 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -83.38 -103.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.288 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.04 -34.11 64.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.738 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -64.57 -5.56 5.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.28 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.6 -49.95 71.35 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.969 0.414 . . . . 0.0 110.682 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.533 ' O ' ' N ' ' B' ' 34' ' ' TYR . 12.2 tmm? -56.45 -48.35 77.25 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.797 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -52.83 -39.47 62.5 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.388 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.443 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 7.9 t -73.36 -54.5 8.17 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.116 -0.633 . . . . 0.0 110.773 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.463 ' OH ' ' CE2' ' B' ' 10' ' ' PHE . 38.0 t80 -63.08 -25.07 68.2 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.082 0.467 . . . . 0.0 110.973 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 30' ' ' MET . 29.7 t80 -72.82 -51.27 19.55 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.367 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.515 HH22 ' CG ' ' A' ' 31' ' ' ASN . 19.7 ptp180 -72.48 -20.52 61.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.54 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.8 t -70.8 -54.25 12.34 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.71 -178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.04 -43.39 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.35 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 48.3 t -49.97 -51.64 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.412 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 88.5 p -56.76 -45.91 81.75 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.493 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 93.6 m -68.31 -48.37 65.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.073 0.463 . . . . 0.0 110.873 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 78.0 mt -58.12 -45.78 86.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.515 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 73.2 t -69.41 -40.15 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -70.56 -29.33 65.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.901 ' O ' ' O ' ' B' ' 45' ' ' GLN . 38.5 m-20 -103.69 -150.39 0.42 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.831 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . 0.901 ' O ' ' O ' ' B' ' 44' ' ' ASP . 46.2 tt0 34.13 130.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.942 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.51 87.74 1.18 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.625 0.726 . . . . 0.0 109.727 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -141.26 -27.45 0.69 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.344 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -179.21 141.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 111.091 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 15.9 p30 -59.9 -38.5 82.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.468 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -64.32 -39.97 94.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.426 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 38.0 t -61.42 -62.7 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.537 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.52 -31.99 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.34 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 51.4 tp -69.73 -42.2 74.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.34 0.591 . . . . 0.0 110.895 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.474 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 24.1 pttt -53.48 -37.29 62.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.217 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.581 ' HE ' HE22 ' B' ' 45' ' ' GLN . 92.3 mtt-85 -65.15 -30.46 71.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.348 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 20.8 mm -74.52 -46.78 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.33 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.47 -24.57 67.66 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.08 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 1.6 m-70 -65.63 -50.47 64.89 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.58 -20.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' B' ' 58' ' ' HIS . 81.6 m-20 -52.29 -45.45 65.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.381 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.401 ' CG ' ' N ' ' B' ' 62' ' ' ALA . 8.2 pt-20 -62.82 -41.13 99.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.529 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . 0.401 ' N ' ' CG ' ' B' ' 61' ' ' GLU . . . -71.96 -47.14 54.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.891 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -42.69 58.15 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.102 0.477 . . . . 0.0 109.84 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.78 -36.31 80.24 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.551 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -62.58 -40.86 98.22 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.35 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.9 t -59.75 -50.49 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.253 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -51.19 18.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.078 0.942 . . . . 0.0 111.749 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.52 -36.13 68.84 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.859 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.37 -9.27 67.94 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 . . . . . 0 N--CA 1.467 0.396 0 CA-C-O 121.131 0.491 . . . . 0.0 110.428 179.947 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.032 0.444 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.587 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.1 t -67.33 -39.17 18.89 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.998 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.587 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -52.93 -21.67 16.25 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.896 1.731 . . . . 0.0 112.087 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.22 -43.86 90.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 110.635 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.454 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -64.01 -44.27 93.11 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.584 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 14' ' ' LEU . 25.1 mt -66.77 -42.26 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.519 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -49.42 -26.06 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.251 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.13 -33.34 70.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.402 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ILE . 36.4 mt -72.15 -37.41 69.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.594 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.48 -38.98 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.136 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -65.55 -35.6 81.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.451 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.09 -51.42 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.654 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.4 pt -74.45 -43.91 48.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.179 0.514 . . . . 0.0 111.025 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -64.73 -52.15 58.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.543 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 35.7 mtt -104.75 -161.92 0.85 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.198 0.523 . . . . 0.0 110.022 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -150.78 47.91 0.86 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -57.14 -49.58 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.517 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.4 p -175.45 68.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.496 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -167.12 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.4 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -158.35 -166.25 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.121 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -80.91 -106.07 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.552 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.564 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.3 tt -64.57 -37.14 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 120.954 0.407 . . . . 0.0 110.568 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.85 9.79 0.08 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.588 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.564 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.07 -42.64 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -62.01 -47.05 86.52 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.166 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.643 ' ND2' ' HE ' ' B' ' 35' ' ' ARG . 36.8 t-20 -51.9 -43.71 63.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.481 -178.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.8 m -71.11 -54.11 12.25 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.959 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.454 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 49.5 t80 -61.25 -43.79 98.3 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.746 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 30' ' ' MET . 39.2 t80 -58.56 -47.97 82.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.797 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.45 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 81.3 mtp180 -69.16 -27.67 65.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.376 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.7 t -66.46 -46.68 75.58 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.541 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.1 t -68.28 -45.87 81.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.513 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.5 t -51.87 -47.85 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.411 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 t -57.32 -42.66 82.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.435 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.9 m -64.88 -45.28 86.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.941 0.4 . . . . 0.0 110.746 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.58 -47.17 85.17 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.614 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.5 t -71.68 -38.33 66.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.781 0.325 . . . . 0.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -71.76 -33.28 68.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.637 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 1.129 ' O ' ' O ' ' A' ' 45' ' ' GLN . 30.5 m-20 -74.59 173.83 9.88 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 1.129 ' O ' ' O ' ' A' ' 44' ' ' ASP . 15.3 pt20 5.64 -164.01 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 117.472 -1.251 . . . . 0.0 113.268 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.11 28.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.553 1.069 . . . . 0.0 109.769 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.2 t -60.28 -42.57 95.72 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.334 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.556 ' O ' HG22 ' A' ' 51' ' ' VAL . 82.5 tttt -162.82 135.41 5.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.429 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -62.22 -10.17 9.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.533 0.683 . . . . 0.0 111.521 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.525 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -73.88 -51.69 15.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.149 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 48' ' ' LYS . 12.0 m -59.26 -56.44 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.524 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.517 ' N ' ' CG2' ' A' ' 51' ' ' VAL . 4.3 m -51.81 -33.19 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-O 121.379 0.609 . . . . 0.0 110.391 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 tt -74.68 -29.66 61.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.549 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.454 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 11.2 pttm -51.99 -37.89 54.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.619 0.724 . . . . 0.0 110.315 -179.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -75.71 -37.2 59.65 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.308 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 67.7 mt -58.66 -50.61 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.14 -179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -58.62 -37.05 75.04 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.454 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 9.0 m-70 -74.55 -39.75 62.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.368 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.4 -34.74 58.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.346 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -50.26 -26.19 4.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.551 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.99 -37.85 83.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.781 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.97 -49.51 28.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -39.46 34.21 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.938 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -64.74 -41.04 96.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.444 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -64.26 -33.11 75.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.307 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.04 -42.78 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-O 121.695 0.759 . . . . 0.0 110.344 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -66.68 -46.86 74.26 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.163 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -78.05 -14.66 59.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.339 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.84 -40.22 5.32 Favored Glycine 0 N--CA 1.47 0.932 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 110.422 -179.903 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.861 0.362 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.7 t -71.02 -39.96 9.03 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.892 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 64.6 Cg_exo -52.42 -15.77 4.34 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.987 1.792 . . . . 0.0 112.034 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -67.57 -51.57 49.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.944 0.402 . . . . 0.0 110.378 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -40.82 96.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.311 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -63.12 -42.8 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.509 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -49.13 -23.78 1.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.586 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.417 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.468 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 7.1 mp -70.15 -39.72 75.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.533 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -57.14 -31.58 65.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.046 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.97 -35.39 80.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.52 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -62.58 -52.05 64.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.879 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.7 -43.87 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.408 0.623 . . . . 0.0 110.806 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -63.91 -23.8 67.49 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.473 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 36.6 mtt -138.6 -146.89 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.109 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -170.08 39.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.223 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . 0.429 ' O ' ' OG ' ' B' ' 23' ' ' SER . 1.1 tm0? -50.99 -40.2 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.967 0.413 . . . . 0.0 110.756 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 5.0 m -177.46 64.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.185 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -164.66 -135.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.312 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -157.23 -161.31 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.26 0.552 . . . . 0.0 110.318 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -86.49 -103.59 0.07 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.352 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' B' ' 29' ' ' ALA . 44.8 mm -64.6 -40.99 90.97 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -61.16 3.39 0.1 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.789 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -74.08 -44.87 52.45 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.55 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.576 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.83 -47.23 84.29 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.25 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.576 ' N ' ' SD ' ' B' ' 30' ' ' MET . 2.0 t30 -54.97 -53.36 56.66 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.714 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -62.49 -53.29 57.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.833 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.38 -49.08 78.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.495 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' B' ' 30' ' ' MET . 35.3 t80 -57.86 -54.56 45.48 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.794 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.643 ' HE ' ' ND2' ' A' ' 31' ' ' ASN . 6.9 tmm_? -61.63 -32.73 72.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 121.155 0.503 . . . . 0.0 110.429 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -68.75 -44.14 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.771 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 38.5 t -66.59 -63.95 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.646 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.44 ' CG2' ' N ' ' B' ' 39' ' ' SER . 20.2 m -48.5 -45.87 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.518 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.44 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 46.1 t -60.15 -41.08 91.98 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.281 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -69.0 -49.21 59.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.968 0.413 . . . . 0.0 110.708 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.66 -40.4 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.514 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . 0.433 ' O ' ' CG1' ' B' ' 42' ' ' VAL . 60.7 t -85.1 19.76 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.076 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -162.12 21.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -161.98 14.14 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -172.6 55.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.545 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 mt -87.67 48.63 1.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.409 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -72.28 -27.17 62.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.31 0.576 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -172.32 133.74 0.67 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.868 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.424 ' O ' ' HB2' ' B' ' 53' ' ' LEU . 10.0 m120 -52.38 -42.87 64.35 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.465 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.59 86.99 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.939 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -51.97 -44.23 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.434 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.46 -39.75 23.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.185 0.516 . . . . 0.0 110.642 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' B' ' 49' ' ' ASN . 0.2 OUTLIER -55.44 -58.62 7.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.912 -178.4 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -55.71 -37.96 69.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.365 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -64.2 -41.34 97.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.481 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.425 ' O ' ' N ' ' B' ' 59' ' ' LEU . 94.3 mt -65.74 -49.0 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.264 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -49.41 -30.85 8.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.237 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -71.42 -29.24 64.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' B' ' 56' ' ' ILE . 0.4 OUTLIER -77.46 -26.32 51.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.125 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -61.94 -54.6 39.54 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.455 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -62.35 -26.45 68.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.703 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -52.09 17.62 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 120.826 0.346 . . . . 0.0 110.851 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.433 ' CD1' ' C ' ' B' ' 63' ' ' TYR . 0.0 OUTLIER -53.35 -44.68 68.7 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.017 -179.661 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -66.58 -31.17 71.7 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.159 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -63.61 -31.27 72.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.531 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -63.75 -55.44 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.3 0.572 . . . . 0.0 110.656 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -69.8 -46.37 65.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.347 1.07 . . . . 0.0 111.881 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -44.27 -35.93 2.52 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.068 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.49 -55.76 4.15 Favored Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.642 0.258 . . . . 0.0 110.844 -179.782 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 9' ' ' TYR . 3.2 t . . . . . 0 N--CA 1.472 0.636 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.439 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -34.22 -53.03 0.93 Allowed Pre-proline 0 N--CA 1.482 1.171 0 CA-C-N 118.225 0.466 . . . . 0.0 111.146 178.276 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 11.3 Cg_endo -51.29 -21.17 9.31 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 120.407 0.738 . . . . 0.0 112.671 178.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.521 ' N ' ' O ' ' A' ' 6' ' ' SER . 7.3 t80 -62.2 -42.96 99.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.341 0.591 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.1 -52.49 6.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.879 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.2 mt -53.66 -35.85 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.601 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -49.3 -31.07 8.37 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.22 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.476 ' OD1' ' NE2' ' A' ' 17' ' ' HIS . 53.4 t-20 -72.37 -45.34 60.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.211 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.5 mt -61.45 -42.5 98.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.613 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.31 -38.84 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -69.04 -33.92 74.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.685 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.476 ' NE2' ' OD1' ' A' ' 13' ' ' ASN . 8.8 m-70 -63.62 -51.74 63.92 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.715 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.5 pt -70.17 -42.54 79.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.119 0.485 . . . . 0.0 110.938 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -57.63 -52.2 66.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.206 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 63.6 mtm -114.29 -125.53 0.28 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.432 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -170.07 61.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.396 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.19 51.74 0.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.968 0.889 . . . . 0.0 110.91 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 23' ' ' SER . 3.4 p 77.42 46.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.257 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -147.18 -142.88 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.627 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -153.54 -168.28 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.234 0.54 . . . . 0.0 110.657 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.33 -100.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.176 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.671 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.0 tp -63.53 -42.45 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -63.82 19.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.873 0.368 . . . . 0.0 110.99 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.671 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -79.73 -46.7 16.57 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.268 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -64.98 -50.64 65.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.252 -179.2 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.478 ' N ' ' SD ' ' A' ' 30' ' ' MET . 82.5 m-20 -51.41 -38.55 54.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.453 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 t -77.2 -54.26 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.615 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.443 ' O ' ' OG ' ' A' ' 36' ' ' SER . 58.4 t80 -63.95 -47.69 79.45 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.18 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.564 ' N ' ' O ' ' A' ' 30' ' ' MET . 57.7 t80 -55.56 -51.77 65.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.751 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.6 ttt85 -63.35 -34.73 78.35 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 33' ' ' TYR . 52.7 p -63.93 -42.52 97.33 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.364 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.98 -56.83 9.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.376 -0.529 . . . . 0.0 110.171 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.7 t -50.01 -45.35 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.417 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.1 m -68.69 -18.74 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.668 0.27 . . . . 0.0 110.416 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.512 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.4 m -88.63 -54.31 4.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.066 0.46 . . . . 0.0 110.961 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.5 mt -61.5 -39.5 91.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.445 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 p -69.31 -25.53 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.4 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -98.75 -22.13 16.03 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.191 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 40' ' ' THR . 14.3 m-20 -91.04 -34.77 14.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.948 0.404 . . . . 0.0 110.518 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.41 HE22 ' CZ ' ' A' ' 55' ' ' ARG . 9.5 tt0 -106.98 161.6 14.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.374 0.607 . . . . 0.0 110.211 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -168.27 22.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.367 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 49.9 m -61.5 -42.99 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.467 0.651 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -173.86 141.51 0.81 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.703 -179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -48.78 -38.39 21.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.38 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.03 -50.16 51.1 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.351 -0.539 . . . . 0.0 110.765 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.439 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 37.5 t -52.41 -43.57 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.499 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.4 m -78.69 -37.92 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.242 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -62.28 -46.29 89.42 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.098 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 17.9 ptmt -54.85 -40.93 70.15 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.03 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.416 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 93.1 mtt180 -63.95 -39.54 94.38 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.824 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.9 mt -69.06 -48.66 68.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.6 -34.4 71.08 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.411 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 51.0 m170 -76.56 -43.14 40.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.871 0.367 . . . . 0.0 110.358 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.4 tp -48.76 -22.63 0.84 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.447 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 10.8 p-10 -58.6 -26.66 63.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.021 0.438 . . . . 0.0 110.416 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 10.4 pt-20 -60.85 -38.63 86.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.407 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.28 -55.06 10.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.401 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.665 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -51.23 -46.07 62.17 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.264 0.554 . . . . 0.0 110.211 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -61.66 -33.09 73.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.128 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.6 tptm -62.8 -39.61 94.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.85 -48.72 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.339 0.59 . . . . 0.0 110.132 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -42.71 93.54 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 122.016 0.912 . . . . 0.0 111.523 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -60.87 -34.85 75.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.942 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.2 -25.57 28.41 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 110.864 -0.895 . . . . 0.0 110.864 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 121.131 0.491 . . . . 0.0 110.253 -179.442 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.496 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 18.7 t -46.22 -43.27 32.7 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.369 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 23.8 Cg_exo -66.16 -20.75 56.19 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 120.401 0.734 . . . . 0.0 111.805 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.52 -57.43 3.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.341 0.591 . . . . 0.0 110.942 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -43.91 -47.45 8.4 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.622 -178.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 70.4 mt -66.46 -48.19 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.38 0.61 . . . . 0.0 111.234 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.24 -27.82 0.7 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.716 -178.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' B' ' 17' ' ' HIS . 18.9 m120 -75.13 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.307 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 34.8 mt -61.63 -43.25 99.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.225 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -59.06 -44.03 91.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 20' ' ' MET . 56.5 tt0 -67.57 -29.5 68.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.89 0.376 . . . . 0.0 110.245 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' B' ' 13' ' ' ASN . 47.8 m170 -67.95 -53.69 24.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -72.97 -43.48 58.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.132 0.492 . . . . 0.0 110.707 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -69.56 -48.36 60.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.353 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.437 ' CB ' ' O ' ' B' ' 16' ' ' GLN . 3.9 tpp -99.94 -163.7 1.05 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.357 0.599 . . . . 0.0 110.19 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -155.78 41.55 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.436 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -58.88 -49.2 78.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.469 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -175.45 69.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -163.8 -148.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.083 0.468 . . . . 0.0 110.201 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -142.76 -164.46 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.363 0.601 . . . . 0.0 110.43 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -88.81 -104.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.441 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.05 -40.67 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -60.02 -14.5 16.59 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.261 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.97 -45.08 51.21 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.525 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 14.0 ptt? -63.4 -52.14 62.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.316 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.525 ' N ' ' CG ' ' B' ' 30' ' ' MET . 97.8 m-20 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.775 -178.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.6 t -63.11 -45.33 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.57 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -75.25 -46.75 31.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.804 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.434 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.2 t80 -49.02 -51.3 31.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.766 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.665 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 67.5 ttt-85 -66.41 -28.94 69.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 5.6 t -62.27 -44.23 97.01 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' B' ' 41' ' ' LEU . 66.4 t -70.79 -58.92 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.862 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -49.43 -49.26 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.763 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 59.7 p -49.04 -61.26 2.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.383 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -73.0 -44.66 60.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 122.443 1.116 . . . . 0.0 111.534 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' B' ' 37' ' ' VAL . 53.6 tp -53.53 -28.51 31.77 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.512 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . 0.459 ' O ' ' CG1' ' B' ' 42' ' ' VAL . 96.1 t -96.48 21.9 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.16 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -138.05 -2.29 1.89 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.457 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -101.83 -38.62 7.76 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 110.358 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -110.29 174.13 6.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.522 0.677 . . . . 0.0 110.018 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -178.61 26.3 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.208 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -71.7 -34.18 69.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.357 0.598 . . . . 0.0 110.725 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 tptm -169.35 129.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.621 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -49.43 -32.38 11.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.232 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.52 -50.77 34.2 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.318 0.58 . . . . 0.0 110.702 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.9 t -49.49 -43.67 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.447 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -75.98 -36.63 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 120.159 -0.616 . . . . 0.0 111.028 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.51 -35.61 81.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.648 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 65.2 mttm -54.6 -44.63 73.23 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.204 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -69.77 -40.78 75.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 80.1 mt -63.67 -54.65 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.801 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.15 -34.13 69.94 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 5.1 m-70 -76.61 -42.47 42.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.478 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 57.1 tp -47.07 -22.15 0.32 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.583 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 21.7 p-10 -58.94 -28.23 66.06 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.372 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 12.5 pt-20 -56.86 -40.48 76.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.343 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -51.44 32.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.571 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -39.21 15.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 121.035 0.445 . . . . 0.0 109.926 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.42 -34.17 77.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.561 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 tptt -57.32 -42.95 82.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.455 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.41 -47.3 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 122.286 1.041 . . . . 0.0 110.718 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.37 92.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.893 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 -67.02 -16.04 64.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.065 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.52 -63.98 1.12 Allowed Glycine 0 N--CA 1.463 0.441 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 110.626 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.722 0.296 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.567 ' CG2' ' HE2' ' A' ' 58' ' ' HIS . 78.1 t -59.47 -44.84 98.58 Favored Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-O 119.036 -0.506 . . . . 0.0 109.858 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -44.7 -31.72 5.25 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.241 1.294 . . . . 0.0 112.317 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.55 -43.05 89.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.923 0.392 . . . . 0.0 110.237 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -66.1 -45.54 80.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.458 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.34 -50.44 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.92 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -47.29 -39.94 15.73 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.676 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -51.84 -30.49 23.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.315 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.58 -41.22 63.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.568 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -54.78 -34.13 62.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 120.92 0.391 . . . . 0.0 110.177 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -64.34 -27.44 69.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.333 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.422 ' O ' ' CA ' ' A' ' 21' ' ' ASN . 2.0 m-70 -71.71 -52.86 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.6 pt -73.98 -38.19 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.446 0.641 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -62.58 -44.67 95.73 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.691 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.443 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 28.8 ttp -114.96 -65.06 1.23 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.294 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.443 ' CB ' ' O ' ' A' ' 20' ' ' MET . 5.6 t30 81.48 45.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -55.18 -37.41 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.166 0.507 . . . . 0.0 110.556 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.1 m -158.12 63.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.643 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.419 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 1.9 tp10 -159.66 -130.93 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.981 0.419 . . . . 0.0 110.491 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 65.3 m-20 -159.39 167.66 28.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.197 0.523 . . . . 0.0 110.429 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -69.9 -99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.454 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.604 ' C ' ' H ' ' A' ' 29' ' ' ALA . 10.7 tp -61.14 -43.15 95.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.015 0.436 . . . . 0.0 110.637 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.423 ' N ' ' CG2' ' A' ' 27' ' ' ILE . 94.8 m-70 -67.72 17.91 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.642 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.604 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -58.97 -51.93 67.96 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 34' ' ' TYR . 66.9 mmm -61.68 -44.55 96.74 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.106 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -46.55 -33.69 4.3 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.562 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 m -89.15 -57.11 3.01 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.913 0.387 . . . . 0.0 110.736 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CE2' ' A' ' 10' ' ' PHE . 38.6 t80 -61.37 -53.06 61.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 28.0 t80 -49.01 -49.55 40.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.234 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -66.5 -28.56 68.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.301 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.5 t -63.4 -46.18 87.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.359 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.551 ' O ' ' N ' ' A' ' 41' ' ' LEU . 35.3 t -71.0 -56.34 10.95 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.5 t -51.36 -47.67 34.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.454 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 p -53.82 -60.28 3.52 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.085 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.1 m -69.49 -44.58 70.81 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.919 0.866 . . . . 0.0 111.045 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' VAL . 41.8 tp -56.26 -27.77 56.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.598 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 98.6 t -101.87 -33.64 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.205 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -80.16 -0.29 35.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.339 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 43.5 t0 -145.46 165.16 29.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.37 0.605 . . . . 0.0 110.252 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.442 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.3 tt0 72.42 -78.28 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.606 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt 42.09 41.15 1.9 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.4 t -73.4 -34.61 65.6 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.397 0.618 . . . . 0.0 110.79 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -167.49 133.68 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.784 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.41 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.9 m120 -49.72 -47.07 50.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.664 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.61 83.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.774 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.0 t -52.96 -43.84 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.547 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 56' ' ' ILE . 28.8 m -81.1 -46.33 20.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.161 0.505 . . . . 0.0 110.556 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' CD1' HE21 ' A' ' 57' ' ' GLN . 0.2 OUTLIER -57.15 -55.94 28.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.808 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 17.4 ptmt -50.99 -40.02 57.04 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.236 0.541 . . . . 0.0 110.411 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.439 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 40.0 ttm180 -65.08 -39.18 92.84 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.147 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 52' ' ' VAL . 34.3 mm -61.36 -52.95 55.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.247 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.496 HE21 ' CD1' ' A' ' 53' ' ' LEU . 75.8 mt-30 -52.52 -40.97 63.03 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.567 ' HE2' ' CG2' ' A' ' 7' ' ' VAL . 2.8 t-80 -66.97 -46.16 75.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.11 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.3 tp -53.0 -23.65 7.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.917 0.389 . . . . 0.0 110.598 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -55.64 -49.26 73.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.434 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 6.2 pt-20 -50.74 -28.59 9.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.684 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.56 -62.22 1.49 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.34 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.43 ' CE2' ' OD1' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -52.47 -38.89 60.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.038 0.447 . . . . 0.0 110.25 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 68' ' ' ARG . 61.4 m-80 -65.32 -27.64 68.74 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.165 -179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -75.88 -39.74 55.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.475 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -63.03 -52.05 64.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.587 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -63.26 -44.96 93.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.801 0.81 . . . . 0.0 111.072 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 64' ' ' ASN . 12.1 mmm180 -55.34 -31.38 61.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.981 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.96 -22.31 61.53 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.391 . . . . 0.0 110.546 -179.935 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 120.945 0.403 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.549 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -57.32 -42.61 96.9 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.967 179.107 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.9 Cg_exo -50.16 -31.16 27.74 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 121.737 1.624 . . . . 0.0 112.097 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -59.98 -43.87 94.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 110.339 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.469 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -63.79 -46.43 85.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.215 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.3 mt -61.11 -47.04 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-O 121.052 0.453 . . . . 0.0 110.587 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -48.43 -35.0 11.91 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -58.39 -34.31 70.59 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 6.6 mp -72.44 -37.23 68.62 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.246 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.82 -38.32 87.7 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.329 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -54.26 -24.93 20.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.556 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.425 ' O ' ' CA ' ' B' ' 21' ' ' ASN . 28.3 m170 -76.38 -54.62 6.49 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -70.84 -38.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.483 0.659 . . . . 0.0 110.625 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -63.72 -43.0 97.83 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 48.9 mtt -115.56 -65.16 1.22 Allowed 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.066 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.444 ' CB ' ' O ' ' B' ' 20' ' ' MET . 24.3 t30 82.9 46.78 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.831 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.7 -40.98 85.22 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.411 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -158.57 69.81 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.576 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -165.17 -125.32 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.076 0.465 . . . . 0.0 110.338 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -158.17 -175.92 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.33 0.586 . . . . 0.0 110.048 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -86.4 -98.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.465 ' C ' ' H ' ' B' ' 29' ' ' ALA . 4.3 mm -61.71 -43.16 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.436 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -62.14 -0.58 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.74 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.465 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.29 -49.86 74.73 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.114 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -68.67 -40.51 80.09 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.283 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' B' ' 30' ' ' MET . 40.7 t30 -55.54 -50.62 69.54 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.668 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.2 t -67.01 -51.45 54.75 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.696 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.469 ' OH ' ' CE2' ' B' ' 10' ' ' PHE . 54.1 t80 -61.43 -50.0 74.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.478 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.474 ' N ' ' O ' ' B' ' 30' ' ' MET . 39.4 t80 -55.98 -48.48 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.104 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -64.87 -34.36 78.19 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.857 0.361 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' B' ' 33' ' ' TYR . 59.2 p -67.75 -39.07 84.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.646 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 43.0 t -68.97 -63.45 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.401 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 23.7 m -50.55 -42.31 21.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.369 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 62.2 p -62.05 -46.23 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.419 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.1 m -63.65 -44.28 94.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.399 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.504 ' O ' ' O ' ' B' ' 44' ' ' ASP . 90.4 mt -70.37 -50.67 36.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.705 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 62.8 t -60.91 -19.19 19.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.082 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -103.62 6.69 37.3 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.855 0.36 . . . . 0.0 110.854 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.504 ' O ' ' O ' ' B' ' 41' ' ' LEU . 39.7 t0 -148.35 170.12 18.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.606 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . 0.421 HE22 HH12 ' B' ' 55' ' ' ARG . 5.4 pt20 39.88 48.28 2.01 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.352 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.37 46.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.353 -179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' THR . . . . . 0.403 ' H ' ' C ' ' B' ' 45' ' ' GLN . 3.6 t -61.04 -41.16 96.05 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.204 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 tptt -167.32 134.43 2.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.754 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -50.24 -37.51 36.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.539 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.98 -51.27 68.76 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.49 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 36.7 t -50.61 -38.65 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.988 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 5.2 t -80.76 -43.06 20.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.597 0.713 . . . . 0.0 111.008 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.93 -52.75 62.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.141 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.48 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 49.9 pttt -51.34 -42.39 61.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.48 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 78.3 mtp180 -65.71 -45.35 83.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.336 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.78 -54.83 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.739 -0.385 . . . . 0.0 110.362 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -53.2 -40.21 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.313 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 57.0 m170 -75.21 -38.27 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.275 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 52.8 tp -51.75 -32.28 30.03 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.63 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.95 -29.03 11.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.482 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -56.69 -35.57 68.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.6 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -60.83 2.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.486 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -43.43 22.22 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.961 0.41 . . . . 0.0 110.158 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -62.05 -39.66 93.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.293 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 tptm -66.74 -36.63 82.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.441 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.4 -51.07 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.232 0.539 . . . . 0.0 110.355 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -66.33 -48.39 70.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.267 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -61.08 -21.64 63.87 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.219 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.6 -27.11 48.52 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 110.336 -179.878 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.27 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.492 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.0 t -47.56 -42.64 44.77 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 118.854 -0.593 . . . . 0.0 110.245 179.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 37.8 Cg_exo -58.62 -22.89 62.71 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 120.754 0.97 . . . . 0.0 111.86 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.77 -48.35 77.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.912 0.387 . . . . 0.0 110.547 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.4 m-85 -48.83 -45.3 40.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.297 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 14' ' ' LEU . 45.9 mt -70.21 -50.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.695 0.76 . . . . 0.0 110.833 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -48.41 -24.13 1.15 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.412 -178.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -72.3 -36.47 68.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.45 . . . . 0.0 110.179 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 11' ' ' ILE . 17.0 mt -70.52 -48.12 57.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.387 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -59.02 -27.8 65.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.287 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -62.53 -27.52 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.18 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.472 ' CE1' ' C ' ' A' ' 24' ' ' GLU . 48.5 t60 -81.86 -60.69 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.488 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -50.9 -39.06 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.836 0.827 . . . . 0.0 110.259 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -72.21 -32.15 66.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.458 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.54 -121.77 0.15 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -174.61 72.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.357 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.432 ' O ' ' OG ' ' A' ' 23' ' ' SER . 68.1 tp60 -77.21 -54.98 5.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.13 0.49 . . . . 0.0 110.198 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 22' ' ' GLN . 1.9 m 170.61 78.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.367 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.472 ' C ' ' CE1' ' A' ' 17' ' ' HIS . 21.3 tp10 -170.68 -131.54 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.288 0.565 . . . . 0.0 110.219 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 17' ' ' HIS . 71.5 m-20 -152.23 176.53 11.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.3 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -72.89 -102.47 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.506 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.441 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.9 mm -64.29 -41.49 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -55.43 -9.23 0.44 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.204 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.441 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -51.88 -42.64 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.513 ' CG ' ' N ' ' A' ' 31' ' ' ASN . 11.6 ptt? -66.05 -54.62 23.56 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.513 ' N ' ' CG ' ' A' ' 30' ' ' MET . 61.6 t-20 -57.3 -55.01 40.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.649 -178.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -56.39 -51.43 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.642 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.471 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 58.5 t80 -63.02 -47.16 84.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -53.4 -43.88 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.864 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -74.73 -28.32 60.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.827 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 p -64.51 -44.91 89.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.43 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.1 t -72.01 -54.18 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.3 t -48.53 -47.01 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.7 t -56.65 -46.94 80.77 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.277 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.4 m -64.57 -45.4 87.2 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.41 0.624 . . . . 0.0 111.272 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.06 -37.83 88.83 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.726 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.409 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 48.5 t -92.9 25.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.695 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -147.49 -0.89 0.64 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.45 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 46' ' ' LEU . 73.4 m-20 -145.41 170.83 15.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.309 0.576 . . . . 0.0 110.288 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 62.35 -71.56 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.428 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' ASP . 15.8 mt 44.53 70.45 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.277 0.561 . . . . 0.0 110.604 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -109.53 -31.12 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.439 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -171.6 129.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.65 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -49.15 -38.8 26.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.513 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.8 76.92 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.847 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.6 t -54.48 -55.14 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.418 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.64 -40.71 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.257 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.96 -43.1 99.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.359 -179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 51.1 mtpt -56.66 -41.19 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.08 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -64.41 -39.9 94.75 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 89.9 mt -69.09 -51.92 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -55.42 -38.44 68.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.143 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 5.5 m-70 -73.36 -22.62 60.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.02 -34.24 77.14 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 41.0 p-10 -47.2 -25.48 0.93 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.013 0.435 . . . . 0.0 110.381 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.451 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 12.6 pt-20 -58.76 -40.1 82.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.331 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.93 -58.05 4.67 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.395 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -46.19 -43.51 15.31 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.139 0.495 . . . . 0.0 110.076 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.98 -44.69 88.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.696 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -62.64 -39.31 93.46 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.915 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.17 -47.19 91.04 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.67 0 CA-C-O 121.855 0.836 . . . . 0.0 109.929 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -65.13 -43.74 90.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.353 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -74.33 -5.04 39.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.096 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.603 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -106.12 -77.57 1.11 Allowed Glycine 0 N--CA 1.46 0.291 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.603 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 pt-20 . . . . . 0 N--CA 1.494 1.764 0 CA-C-N 115.529 -0.335 . . . . 0.0 111.637 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.539 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.76 -42.33 87.01 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.601 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 51.5 Cg_exo -54.07 -23.64 29.57 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 121.476 1.45 . . . . 0.0 112.094 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -67.01 -39.41 87.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.628 0.252 . . . . 0.0 110.573 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.463 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.37 -40.23 90.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.102 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . 0.45 ' O ' ' N ' ' B' ' 14' ' ' LEU . 96.8 mt -68.13 -45.66 82.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.512 0.672 . . . . 0.0 110.796 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -47.76 -25.16 1.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.327 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -73.94 -35.37 64.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.053 0.454 . . . . 0.0 110.166 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 11' ' ' ILE . 29.4 mt -70.89 -39.61 72.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.658 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -57.57 -35.55 70.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.099 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -71.33 -28.91 64.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.632 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 52.0 m170 -67.38 -49.88 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.66 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.86 -43.5 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -59.7 -51.55 69.32 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.373 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 52.1 mtm -118.73 -145.34 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.946 0.403 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -157.49 57.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.344 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 65.2 tp60 -61.11 -45.19 95.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.236 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 t 177.57 69.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -169.73 -133.24 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.402 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -151.01 -166.81 2.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.456 0.646 . . . . 0.0 110.269 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -82.23 -109.46 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.423 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 20.4 tt -65.36 -37.46 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 121.091 0.472 . . . . 0.0 110.552 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -57.37 -22.16 40.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.467 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.98 -33.76 2.16 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.611 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -66.18 -52.75 45.16 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.015 178.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.611 ' N ' ' SD ' ' B' ' 30' ' ' MET . 3.0 t-20 -55.35 -50.97 68.26 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.724 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.4 t -61.29 -48.34 81.85 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.463 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 60.0 t80 -70.25 -20.74 63.05 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 40.2 t80 -73.09 -53.1 11.91 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.297 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -68.83 -23.0 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.495 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -70.0 -47.61 61.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.581 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 66.8 t -70.13 -57.9 6.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.106 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 76.8 t -48.57 -44.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.428 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 52.8 m -58.49 -34.21 70.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.842 0.353 . . . . 0.0 110.434 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.0 m -82.25 -45.96 14.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.759 0.79 . . . . 0.0 111.372 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.463 ' CD1' ' CZ ' ' B' ' 55' ' ' ARG . 3.2 mm? -64.21 -43.55 94.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.619 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 4.3 p -68.17 -20.4 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.054 0.455 . . . . 0.0 109.981 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -98.84 -15.6 19.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -55.64 -47.73 76.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -174.8 126.67 0.29 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 110.565 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 25.0 mt -97.31 39.14 1.2 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.258 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -63.69 -25.35 68.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.684 0.754 . . . . 0.0 110.322 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.497 ' O ' HG22 ' B' ' 51' ' ' VAL . 34.5 tptt -169.41 115.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.826 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 48.4 p30 -50.21 -14.29 0.15 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.174 -0.61 . . . . 0.0 110.985 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' B' ' 48' ' ' LYS . . . -78.31 -55.1 5.51 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 119.905 -0.718 . . . . 0.0 112.292 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . 0.497 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.3 m -48.35 -37.97 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.837 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.4 ' H ' HG22 ' B' ' 51' ' ' VAL . 27.3 m -76.35 -33.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.588 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -38.33 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.363 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -67.58 -47.15 70.57 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.338 0.59 . . . . 0.0 110.298 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.463 ' CZ ' ' CD1' ' B' ' 41' ' ' LEU . 54.8 mtp180 -61.8 -42.89 99.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.2 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.31 -45.02 94.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.218 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -52.11 -37.78 55.28 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.2 -33.84 76.24 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.02 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -40.82 83.66 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.386 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -51.86 -27.25 12.07 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.961 0.41 . . . . 0.0 110.095 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.31 -40.94 98.73 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.34 -53.54 12.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.834 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.39 -43.05 44.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.058 0.456 . . . . 0.0 109.961 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -64.53 -34.77 79.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.137 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -63.68 -34.37 77.71 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.418 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 99.7 t -65.94 -43.0 92.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 122.058 0.932 . . . . 0.0 110.383 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -66.74 -46.01 76.8 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.207 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -76.24 -19.23 58.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.29 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.98 -33.72 9.46 Favored Glycine 0 N--CA 1.471 1.017 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.4 . . . . 0.0 110.265 -179.877 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.515 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -60.08 -44.8 97.41 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.007 179.453 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 77.3 Cg_exo -48.58 -22.68 4.56 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.645 1.564 . . . . 0.0 112.169 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -73.6 -27.2 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.519 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -82.96 -30.38 28.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.135 179.663 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mt -74.05 -52.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 121.691 0.758 . . . . 0.0 111.189 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -52.12 -21.68 3.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.397 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -67.94 -37.18 81.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.49 ' CD1' ' N ' ' A' ' 14' ' ' LEU . 6.4 mp -69.97 -38.18 76.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.118 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.91 -36.7 72.83 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.883 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.56 -27.12 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -70.48 -53.34 16.68 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.983 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.0 pt -71.43 -40.43 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.088 0.47 . . . . 0.0 110.586 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -65.3 -53.08 49.22 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.889 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' MET . . . . . 0.412 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 40.9 mtt -100.16 -65.22 0.98 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.095 0.474 . . . . 0.0 110.33 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 20' ' ' MET . 19.6 t30 79.02 43.58 0.07 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.933 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -55.41 -44.94 76.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.054 0.454 . . . . 0.0 110.491 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.3 p -150.75 67.37 0.94 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.632 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 16.7 tp10 -166.9 -137.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.536 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -148.22 -163.6 1.82 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.159 0.504 . . . . 0.0 110.354 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.473 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.0 tttm -85.91 -109.89 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.1 mt -62.25 -40.95 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -54.94 -21.35 11.44 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.539 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.18 -39.86 30.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.25 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.583 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.2 -46.1 88.59 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.571 179.171 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.583 ' N ' ' SD ' ' A' ' 30' ' ' MET . 9.8 t-20 -55.89 -47.89 76.59 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.658 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 61.8 p -65.63 -53.39 42.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.804 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.416 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 73.3 t80 -62.14 -47.29 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.689 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 30' ' ' MET . 48.2 t80 -57.51 -48.48 79.16 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.697 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' NH2' ' CD2' ' B' ' 63' ' ' TYR . 6.4 tpt180 -64.32 -30.62 71.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.797 0.332 . . . . 0.0 110.36 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.8 t -69.93 -43.02 72.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.15 -63.15 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.769 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 30.9 m -47.21 -42.15 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.678 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.4 m -56.13 -40.36 73.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.828 0.346 . . . . 0.0 110.242 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -71.89 -43.3 65.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.702 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.71 -46.16 89.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.361 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 92.8 t -65.67 -33.1 61.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.096 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -78.9 -18.3 54.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.26 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.938 ' O ' ' O ' ' A' ' 45' ' ' GLN . 42.8 t0 -65.88 169.14 6.98 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 121.217 0.532 . . . . 0.0 109.711 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.938 ' O ' ' O ' ' A' ' 44' ' ' ASP . 14.5 pt20 -13.12 -131.64 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.698 0 CA-C-O 118.51 -0.757 . . . . 0.0 112.684 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 173.75 35.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 118.379 0.536 . . . . 0.0 110.066 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.6 m -47.32 -49.58 23.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.209 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.433 ' C ' ' N ' ' A' ' 50' ' ' ALA . 16.0 tptp -169.84 134.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -48.98 -16.04 0.12 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.421 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.433 ' N ' ' C ' ' A' ' 48' ' ' LYS . . . -78.44 -54.82 5.76 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.489 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.42 HG22 ' N ' ' A' ' 52' ' ' VAL . 23.9 m -49.99 -39.29 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.534 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.42 ' N ' HG22 ' A' ' 51' ' ' VAL . 18.3 m -77.5 -40.27 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.171 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.1 -37.61 87.89 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.81 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.452 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 93.3 mttt -58.83 -42.16 88.61 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.163 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -70.63 -40.94 72.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.442 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.41 -50.37 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.427 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -57.0 -38.55 73.25 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -69.0 -38.7 79.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.735 0.303 . . . . 0.0 110.355 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.48 -24.93 14.39 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.62 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 15.2 p-10 -51.56 -28.36 13.64 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.469 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.452 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 9.1 pt-20 -63.47 -31.9 73.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.504 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.66 -60.12 2.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.505 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -39.7 60.58 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.089 0.471 . . . . 0.0 110.415 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.1 -38.82 91.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.481 -178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.3 mmtt -63.35 -33.02 74.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.319 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.58 -46.25 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.523 0.678 . . . . 0.0 110.509 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.427 ' CB ' ' HZ2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -66.83 -43.19 84.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.471 -179.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -87.3 2.63 49.64 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.035 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.08 -38.55 1.13 Allowed Glycine 0 N--CA 1.478 1.473 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.473 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 pp20? . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 120.708 0.29 . . . . 0.0 110.273 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.514 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.86 -44.23 94.18 Favored Pre-proline 0 CA--C 1.543 0.685 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.957 179.42 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.7 Cg_exo -50.03 -21.68 6.72 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 121.703 1.602 . . . . 0.0 112.21 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.94 -42.73 94.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.922 0.391 . . . . 0.0 110.497 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.467 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.9 m-85 -60.8 -43.47 98.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.291 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.37 -43.53 97.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.262 0.553 . . . . 0.0 110.472 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -51.34 -28.39 12.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.501 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.44 -35.7 73.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.212 0.529 . . . . 0.0 110.575 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 37.9 mt -67.68 -38.33 83.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.462 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -56.49 -40.77 75.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' B' ' 20' ' ' MET . 55.5 tt0 -66.56 -34.86 78.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.323 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -64.0 -51.68 63.11 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.754 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.13 -40.9 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.111 0.481 . . . . 0.0 110.71 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -72.03 -52.51 16.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.773 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.454 ' N ' ' O ' ' B' ' 16' ' ' GLN . 15.3 tpp -87.05 -63.84 1.24 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.16 0.505 . . . . 0.0 110.45 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 69.85 40.77 1.26 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.92 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -53.56 -35.2 60.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.058 0.456 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -165.59 64.44 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.657 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . 0.401 ' CG ' ' H ' ' B' ' 25' ' ' ASP . 5.1 tp10 -158.6 -132.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.333 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . 0.401 ' H ' ' CG ' ' B' ' 24' ' ' GLU . 55.0 m-20 -153.05 -176.27 5.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.548 0.689 . . . . 0.0 110.081 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -80.81 -105.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.572 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.3 mm -60.33 -39.84 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -69.21 18.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.096 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.572 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.82 -49.51 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.381 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.561 ' SD ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -56.31 -38.01 70.7 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.386 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.54 ' N ' ' SD ' ' B' ' 30' ' ' MET . 58.5 t-20 -50.69 -44.11 57.83 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.321 -178.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.7 t -74.46 -54.97 6.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.719 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.467 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 88.2 t80 -59.04 -49.8 76.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.535 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.539 ' N ' ' O ' ' B' ' 30' ' ' MET . 22.7 t80 -55.31 -45.47 76.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -63.98 -33.86 76.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 34.3 t -68.56 -45.08 73.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.503 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . 0.615 ' O ' ' N ' ' B' ' 41' ' ' LEU . 88.4 t -67.95 -62.7 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.305 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' B' ' 39' ' ' SER . 8.0 p -48.17 -44.39 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.607 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.437 ' N ' ' CG1' ' B' ' 38' ' ' VAL . 50.8 p -57.82 -57.9 10.73 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.054 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.3 m -73.59 -43.19 60.34 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 122.39 1.09 . . . . 0.0 111.287 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.615 ' N ' ' O ' ' B' ' 37' ' ' VAL . 41.8 tp -54.14 -41.57 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.37 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -80.46 -16.55 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -83.21 -17.09 43.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.465 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.543 ' CG ' ' H ' ' B' ' 45' ' ' GLN . 24.5 t0 -104.75 -151.87 0.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.103 0.477 . . . . 0.0 109.715 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . 0.543 ' H ' ' CG ' ' B' ' 44' ' ' ASP . 73.5 tp60 31.9 -93.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.152 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ASP . 10.3 mt 54.37 75.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.178 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -136.27 -25.54 1.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.579 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -165.06 128.78 2.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -49.48 -33.57 14.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.475 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.63 -49.98 35.03 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.021 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 t -50.58 -45.2 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.379 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.5 -35.88 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.804 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 55.3 tp -62.58 -39.79 94.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.486 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.476 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 93.9 mttt -58.41 -43.01 88.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.23 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -68.74 -40.61 79.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.2 -51.38 73.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -54.23 -39.15 66.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.212 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 32.2 m170 -67.54 -35.05 78.31 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.264 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -37.65 83.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.254 -179.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -55.77 -32.71 63.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.417 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -58.96 -35.12 72.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.503 . . . . 0.0 110.453 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.62 19.03 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.85 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.615 ' CD2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -52.1 -50.14 62.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.302 0.572 . . . . 0.0 109.746 -179.537 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.4 t30 -62.44 -32.07 72.88 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.377 -178.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -60.57 -36.76 79.3 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.228 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 59.3 t -64.39 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 123.333 1.54 . . . . 0.0 110.863 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.647 ' C ' ' H ' ' B' ' 69' ' ' GLY . 7.2 mmmt -72.31 -30.67 65.0 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 113.637 -1.619 . . . . 0.0 111.496 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 49.2 ttt85 -55.02 1.06 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.608 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . 0.647 ' H ' ' C ' ' B' ' 67' ' ' LYS . . . 97.19 18.53 28.68 Favored Glycine 0 N--CA 1.46 0.235 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.499 0.666 . . . . 0.0 110.145 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.689 0.28 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.578 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -68.78 -40.18 16.61 Favored Pre-proline 0 CA--C 1.539 0.549 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.578 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 78.4 Cg_exo -52.08 -27.18 28.2 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 121.731 1.62 . . . . 0.0 111.883 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -61.71 -41.76 98.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -58.15 -39.04 77.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.053 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.8 -45.91 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-O 121.451 0.644 . . . . 0.0 110.507 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -49.11 -24.09 1.5 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.806 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -74.92 -30.04 61.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.544 0.688 . . . . 0.0 110.695 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.443 HD21 ' CG ' ' A' ' 33' ' ' TYR . 25.1 mt -70.04 -39.5 75.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.601 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -51.22 -39.21 56.08 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.258 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -67.29 -36.52 81.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.406 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.62 -51.42 68.58 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.665 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.2 pt -73.84 -43.77 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.267 0.556 . . . . 0.0 110.958 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -65.55 -54.3 30.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.672 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.5 mtt -101.03 -160.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 109.861 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -151.82 47.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.96 -49.05 74.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.0 p -176.2 65.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.404 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 12.4 tp10 -163.06 -137.02 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.98 0.419 . . . . 0.0 110.203 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -157.79 -166.96 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 110.16 -179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -81.81 -103.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.56 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.567 ' C ' ' H ' ' A' ' 29' ' ' ALA . 4.8 tt -65.12 -36.25 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.509 -179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 83.8 t60 -65.65 11.25 0.07 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.678 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.567 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -80.36 -44.39 19.52 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.921 0.391 . . . . 0.0 110.653 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.493 ' O ' ' N ' ' A' ' 34' ' ' TYR . 12.3 ptt? -58.8 -47.9 83.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.164 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' ' CG ' ' A' ' 30' ' ' MET . 12.2 m120 -53.06 -53.91 43.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.809 -178.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.42 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 73.3 m -57.99 -51.25 70.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.512 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.443 ' CG ' HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -64.64 -25.52 67.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.124 179.274 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.493 ' N ' ' O ' ' A' ' 30' ' ' MET . 53.9 t80 -71.64 -55.43 7.76 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.054 0.454 . . . . 0.0 110.358 -178.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -65.98 -24.71 66.84 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.454 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -67.23 -51.61 51.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.69 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.45 -55.42 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.6 t -49.48 -53.32 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.662 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -50.35 -56.68 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.842 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 44' ' ' ASP . 18.9 m -61.51 -42.9 99.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.208 0.528 . . . . 0.0 110.521 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -44.4 94.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.409 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 82.6 t -73.55 -40.0 54.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.027 0.442 . . . . 0.0 110.276 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -73.01 -21.39 60.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.708 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.602 ' CG ' ' H ' ' A' ' 45' ' ' GLN . 26.7 t70 -101.36 -152.07 0.43 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.097 0.475 . . . . 0.0 110.008 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.602 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 5.9 tp-100 30.42 -91.97 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.412 0.625 . . . . 0.0 111.425 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 44' ' ' ASP . 7.3 mt 56.74 101.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.041 178.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.1 t -168.29 -28.13 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.897 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.519 ' O ' HG21 ' A' ' 51' ' ' VAL . 38.1 tptt -164.15 129.38 2.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.87 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.52 -18.1 1.01 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.989 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.9 -57.04 4.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.869 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 48' ' ' LYS . 28.7 m -46.64 -36.31 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.755 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.451 ' N ' HG21 ' A' ' 51' ' ' VAL . 34.1 m -81.72 -33.76 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 178.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 39.4 tp -57.3 -55.86 29.34 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.444 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 18.9 ptmt -52.62 -42.55 64.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.317 0.58 . . . . 0.0 110.291 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.444 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 25.8 mmt85 -61.14 -40.95 95.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.753 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.1 mm -69.68 -49.57 57.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.312 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -56.02 -46.08 78.92 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.495 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -66.98 -45.32 78.0 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.245 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.405 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 38.8 tp -50.2 -24.86 3.09 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.794 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -62.93 -32.99 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.241 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -62.34 -39.55 93.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.715 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -58.29 5.71 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.571 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.461 ' OH ' ' NZ ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -54.05 -42.07 68.82 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 109.877 -179.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.418 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 59.8 t-20 -66.02 -40.87 91.44 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.588 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -61.49 -39.59 91.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.44 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.0 t -53.55 -59.88 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.454 -179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' NZ ' ' OH ' ' A' ' 63' ' ' TYR . 32.0 mtmt -62.45 -46.42 88.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.977 0.894 . . . . 0.0 111.437 -179.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -52.11 -15.67 0.62 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.052 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.407 ' N ' ' C ' ' A' ' 67' ' ' LYS . . . -101.16 -13.76 32.67 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 67' ' ' LYS . 80.3 mm-40 . . . . . 0 N--CA 1.466 0.352 0 CA-C-O 120.648 0.261 . . . . 0.0 110.369 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' SER . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.3 p . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' B' ' 6' ' ' SER . 3.5 t -35.25 -54.67 1.12 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.076 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 19.3 Cg_endo -53.37 -22.24 20.24 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 121.366 1.377 . . . . 0.0 112.44 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 6' ' ' SER . 12.4 t80 -66.98 -44.76 79.6 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.769 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.476 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.1 m-85 -71.66 -46.42 58.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.759 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 40.1 mt -61.14 -44.83 99.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.275 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -49.8 -31.39 11.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.231 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . 0.606 HD22 ' HE2' ' B' ' 17' ' ' HIS . 5.4 t-20 -71.38 -43.44 66.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.386 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -62.67 -39.09 92.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.244 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.258 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -75.2 -28.22 59.92 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.014 0.435 . . . . 0.0 110.696 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.606 ' HE2' HD22 ' B' ' 13' ' ' ASN . 34.7 m170 -65.43 -51.49 59.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' B' ' 19' ' ' GLU . 3.7 pt -73.08 -44.55 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.085 0.469 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' B' ' 18' ' ' ILE . 72.0 mm-40 -67.48 -50.43 59.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.129 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.0 tpp -94.0 -152.81 0.35 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.538 0.685 . . . . 0.0 109.98 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.97 41.92 0.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.003 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -55.25 -50.5 69.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.237 0.541 . . . . 0.0 110.491 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 36.7 p -174.62 65.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.289 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -162.86 -146.9 0.11 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.913 0.387 . . . . 0.0 110.403 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -144.44 -163.41 1.68 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.113 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -81.54 -108.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.5 mt -64.72 -42.26 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -50.16 -28.79 7.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.82 -31.67 1.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.728 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -65.82 -50.69 63.71 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.355 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' B' ' 30' ' ' MET . 10.8 t30 -57.56 -56.73 18.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.964 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 63.7 p -54.54 -45.57 73.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.476 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 76.3 t80 -70.15 -34.53 73.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.538 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' B' ' 30' ' ' MET . 25.3 t80 -61.65 -47.81 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.612 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.482 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.7 mpt_? -69.51 -26.48 64.55 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -68.68 -46.38 69.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.8 t -64.89 -66.12 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.544 -0.863 . . . . 0.0 110.835 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 25.1 m -44.6 -39.82 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.577 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 11.0 t -60.73 -44.93 96.02 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.142 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.7 m -69.67 -46.47 66.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 0.0 110.998 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.413 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -60.28 -33.74 72.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.46 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -87.63 -37.58 10.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -73.12 -14.97 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.672 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' B' ' 41' ' ' LEU . 33.6 t70 -143.67 160.52 40.55 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.484 0.659 . . . . 0.0 110.051 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 41.25 63.35 1.25 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.083 -179.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.87 42.11 1.68 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.56 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.1 t -54.92 -44.01 73.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.764 0.792 . . . . 0.0 110.455 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.419 ' O ' HG23 ' B' ' 51' ' ' VAL . 38.2 tptt -146.81 127.44 14.22 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.881 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -50.19 -15.03 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.939 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.404 ' N ' ' C ' ' B' ' 48' ' ' LYS . . . -77.08 -55.79 5.14 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.596 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . 0.446 HG23 ' H ' ' B' ' 52' ' ' VAL . 28.2 m -48.08 -38.0 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.773 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . 0.446 ' H ' HG23 ' B' ' 51' ' ' VAL . 30.1 m -78.68 -34.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.144 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.14 -42.25 90.24 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.427 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -56.29 -43.81 79.23 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.018 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.29 -45.06 93.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.93 -52.04 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.786 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -55.32 -41.39 72.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.391 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.21 -38.83 63.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.331 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 5.8 tt -52.63 -26.2 12.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.082 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -52.43 -28.59 20.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.438 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.46 -32.85 74.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.91 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.75 -62.92 1.21 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.748 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.49 -38.97 14.87 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -65.07 -38.55 91.15 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.128 0.49 . . . . 0.0 110.071 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.2 tptp -63.33 -33.07 74.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.179 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 60.6 t -62.57 -46.75 95.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.928 0.87 . . . . 0.0 110.466 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -71.52 -43.0 67.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.203 1.001 . . . . 0.0 112.011 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 29.6 mmm-85 -79.09 -14.14 59.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.478 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -95.88 -42.12 3.65 Favored Glycine 0 N--CA 1.469 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.802 0.334 . . . . 0.0 110.329 -179.934 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.451 -0.398 0 CA-C-O 121.22 0.533 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.496 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -52.42 -50.25 80.97 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.143 179.07 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 58.1 Cg_exo -41.59 -27.64 0.53 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 121.845 1.697 . . . . 0.0 112.32 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -60.48 -39.43 87.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 110.205 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.8 m-85 -58.05 -47.05 84.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -66.1 -47.14 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.465 0.65 . . . . 0.0 110.62 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -50.61 -28.55 8.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.62 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -72.36 -37.78 68.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.37 0.605 . . . . 0.0 110.648 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.3 mt -67.53 -35.19 78.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.163 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -52.16 -41.85 62.92 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.34 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -68.01 -36.46 80.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.834 0.35 . . . . 0.0 110.675 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.1 -49.3 78.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.721 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.422 HG13 ' N ' ' A' ' 19' ' ' GLU . 27.0 pt -73.24 -41.43 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.783 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' HG13 ' A' ' 18' ' ' ILE . 47.6 tp10 -55.06 -53.98 48.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.311 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 17.9 ptp -121.25 -134.59 0.31 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.241 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -159.88 53.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.159 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -55.7 -46.41 77.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.3 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.0 p -175.42 57.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -164.71 -139.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.285 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -147.86 -166.3 2.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.349 0.595 . . . . 0.0 110.54 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.5 -105.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.471 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.414 ' O ' ' CG ' ' A' ' 30' ' ' MET . 17.4 tt -63.96 -41.83 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.163 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -55.65 -11.58 0.97 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.592 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -49.84 -42.83 48.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.593 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.553 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.1 ptm -65.98 -54.76 22.03 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.194 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.484 ' H ' ' HG3' ' A' ' 30' ' ' MET . 19.0 t-20 -51.61 -47.83 63.48 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.495 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 36' ' ' SER . 39.9 t -68.31 -54.54 16.72 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.648 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.422 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 42.8 t80 -60.63 -48.97 79.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.642 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.553 ' N ' ' O ' ' A' ' 30' ' ' MET . 66.3 t80 -51.88 -43.27 63.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.791 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.6 ttm-85 -77.16 -26.58 53.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.419 ' OG ' ' O ' ' A' ' 32' ' ' SER . 30.0 m -64.79 -46.83 80.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.771 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 26.6 m -76.23 -44.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.526 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.424 ' CG2' ' O ' ' A' ' 34' ' ' TYR . 24.6 t -46.61 -43.33 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.207 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.0 p -58.61 -35.09 71.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.029 0.443 . . . . 0.0 110.506 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 44' ' ' ASP . 95.6 m -85.82 -45.22 11.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.723 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.477 ' C ' ' H ' ' A' ' 43' ' ' GLN . 4.4 mm? -63.21 -45.73 90.31 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.039 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.8 p -68.67 3.99 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.294 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.477 ' H ' ' C ' ' A' ' 41' ' ' LEU . 57.1 tt0 -129.28 -23.34 2.98 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.255 -179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 40' ' ' THR . 23.4 t0 -57.79 121.88 11.54 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.25 0.548 . . . . 0.0 110.035 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.452 ' C ' ' O ' ' A' ' 44' ' ' ASP . 11.2 pt20 31.58 89.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.281 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.23 45.71 0.47 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.393 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -59.17 -31.37 68.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.388 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -165.79 131.21 2.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.228 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -50.04 -32.1 14.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.404 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.49 ' N ' HD21 ' B' ' 49' ' ' ASN . . . -72.42 -48.72 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.386 0.612 . . . . 0.0 110.601 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.1 t -49.13 -42.42 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.751 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.44 -36.36 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.209 0.528 . . . . 0.0 110.295 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -35.82 82.19 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.471 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 59.3 mttp -53.26 -41.98 66.04 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.301 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -65.26 -36.66 84.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.321 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 41.2 mm -66.84 -51.67 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.738 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 77.6 mt-30 -55.37 -40.26 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.348 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.471 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 38.1 m80 -75.73 -40.05 56.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.546 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.2 tp -51.51 -30.89 21.87 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.742 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 11.6 p-10 -52.88 -28.4 22.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.38 0.609 . . . . 0.0 110.624 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.549 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.7 pt-20 -57.93 -36.66 72.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.366 -179.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.6 -53.82 12.47 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.4 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.441 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.95 -41.36 33.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.208 -179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.441 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 39.5 m-80 -68.09 -41.64 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -65.53 -34.81 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.433 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -60.78 -62.31 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.513 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.412 ' C ' ' H ' ' A' ' 69' ' ' GLY . 26.7 mtmt -60.71 -51.86 67.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.349 -0.54 . . . . 0.0 111.148 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 -55.43 -11.86 0.95 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.179 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 67' ' ' LYS . . . -101.83 -28.41 6.62 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.693 0.282 . . . . 0.0 110.638 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.411 0 CA-C-O 120.695 0.283 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.687 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 25.3 t -58.81 -48.58 96.56 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.257 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.687 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 7.4 Cg_endo -47.5 -25.76 5.55 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.969 1.779 . . . . 0.0 112.077 -179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.45 -41.23 98.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.217 0.532 . . . . 0.0 110.449 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.452 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.5 m-85 -59.36 -40.65 87.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.253 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.3 mt -70.04 -43.47 79.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.306 0.574 . . . . 0.0 110.501 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -50.63 -28.78 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.542 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -73.25 -33.28 65.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.034 0.445 . . . . 0.0 110.483 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 25.7 mt -72.0 -38.95 69.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.545 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -56.74 -38.61 72.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.191 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.7 tt0 -66.98 -35.81 80.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.533 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -63.22 -51.86 64.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.949 0.404 . . . . 0.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . 0.413 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.8 pt -72.53 -44.42 61.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.787 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . 0.413 ' N ' HG13 ' B' ' 18' ' ' ILE . 83.2 tt0 -68.85 -53.98 18.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.462 ' N ' ' O ' ' B' ' 16' ' ' GLN . 11.2 tpp -86.75 -153.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.196 0.522 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -162.27 36.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.515 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -46.06 -63.16 1.05 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.995 0.426 . . . . 0.0 110.637 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -172.41 65.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.48 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 19.1 tp10 -154.92 -131.33 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.025 0.44 . . . . 0.0 110.359 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -160.37 -173.86 4.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.343 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -74.35 -106.36 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.604 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.605 ' C ' ' H ' ' B' ' 29' ' ' ALA . 19.0 mt -66.0 -33.49 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -64.01 8.67 0.09 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.859 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.605 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.46 -43.56 31.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.742 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.417 ' CG ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -58.82 -46.86 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.058 -179.749 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -51.99 -48.75 64.27 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.393 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 65.7 p -67.78 -55.68 12.13 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.907 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.452 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 86.2 t80 -56.78 -47.49 80.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.596 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.412 ' N ' ' O ' ' B' ' 30' ' ' MET . 36.7 t80 -58.16 -44.2 87.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.936 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -61.97 -35.46 78.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.281 0.563 . . . . 0.0 110.788 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.2 p -73.92 -44.25 55.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.66 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 50.0 t -69.96 -57.1 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.619 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' B' ' 39' ' ' SER . 5.8 p -48.61 -41.52 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.033 0.444 . . . . 0.0 110.396 -179.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.464 ' N ' ' CG1' ' B' ' 38' ' ' VAL . 42.6 t -64.67 -38.17 90.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.265 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 44' ' ' ASP . 89.0 m -71.95 -44.06 64.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.385 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.66 -44.04 80.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -73.37 -32.4 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -77.65 -35.11 52.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.218 0.532 . . . . 0.0 110.61 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 40' ' ' THR . 98.8 m-20 -39.12 -68.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -174.53 139.67 0.58 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.04 48.32 1.11 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.341 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -61.56 -36.01 79.4 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.004 0.43 . . . . 0.0 110.6 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -166.61 128.48 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.62 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 24.4 p30 -47.91 -34.65 9.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.572 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.511 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -65.79 -49.59 67.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.007 0.432 . . . . 0.0 110.813 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.4 t -50.96 -43.98 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.71 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.2 m -80.68 -37.28 16.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.119 0.485 . . . . 0.0 110.65 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.15 -47.34 83.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.938 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.608 ' HZ2' ' NE ' ' B' ' 55' ' ' ARG . 16.7 pttp -54.16 -41.29 68.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.579 0.704 . . . . 0.0 110.27 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . 0.608 ' NE ' ' HZ2' ' B' ' 54' ' ' LYS . 27.2 mmt180 -65.35 -37.91 88.48 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.136 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 6.0 mm -66.17 -48.56 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.684 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -56.18 -41.86 76.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.405 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -69.17 -38.9 78.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.384 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.83 -36.32 62.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.572 -178.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -53.82 -27.43 29.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.438 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -64.51 -37.95 89.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.452 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.6 -53.65 10.0 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.404 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -51.34 -39.63 57.43 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.056 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . 0.453 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 49.7 t30 -71.02 -38.17 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.251 -178.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 43.0 mmtt -59.66 -32.13 70.19 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.438 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.67 -60.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.46 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -67.83 -45.13 75.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.372 0.606 . . . . 0.0 110.985 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -54.55 -23.21 15.68 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.313 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.89 -7.63 70.55 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.29 0.567 . . . . 0.0 110.37 179.8 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.49 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 29.8 t . . . . . 0 CA--C 1.532 0.271 0 CA-C-O 120.935 0.398 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.6 t -51.71 -55.63 28.23 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.6 178.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 28.1 Cg_exo -36.12 -26.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.353 2.035 . . . . 0.0 112.479 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 7' ' ' VAL . 88.4 t80 -60.7 -43.11 98.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.394 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -56.46 -47.99 78.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.55 -45.09 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.415 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -51.65 -25.19 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.672 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.32 -36.4 74.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 110.48 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 14' ' ' LEU . 8.3 mp -68.41 -37.75 80.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.33 -39.35 86.77 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.259 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -55.23 -26.6 40.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.619 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -73.74 -53.74 9.66 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.849 -179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -71.54 -42.89 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.493 0.664 . . . . 0.0 110.878 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.439 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 79.4 mm-40 -62.17 -53.03 61.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.179 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.3 mtt -103.05 -141.07 0.36 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.088 0.471 . . . . 0.0 110.081 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -169.84 56.5 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -51.61 63.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.193 0.52 . . . . 0.0 110.613 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 t 179.38 73.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.211 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.447 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 6.3 tp10 -164.6 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.995 0.426 . . . . 0.0 110.397 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -149.66 -172.18 4.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.46 0.648 . . . . 0.0 110.213 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -79.75 -108.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.615 ' O ' ' SD ' ' A' ' 30' ' ' MET . 20.0 tt -61.52 -37.52 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -69.56 20.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.067 0.46 . . . . 0.0 111.018 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.581 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -73.9 -45.91 47.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.615 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -59.66 -38.97 82.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.376 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.56 ' N ' ' SD ' ' A' ' 30' ' ' MET . 18.5 m120 -51.4 -44.96 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.272 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.447 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 6.8 t -73.32 -54.5 8.21 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.813 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 64.7 t80 -59.62 -50.66 73.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.542 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.573 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.1 t80 -54.9 -40.8 70.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.818 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.3 ttt-85 -72.33 -27.15 62.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.848 0.356 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -70.59 -44.37 67.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.404 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.57 ' O ' ' N ' ' A' ' 41' ' ' LEU . 59.3 t -66.09 -63.82 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.791 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.212 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.407 ' CG2' ' N ' ' A' ' 39' ' ' SER . 26.3 m -47.18 -43.7 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.965 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.407 ' N ' ' CG2' ' A' ' 38' ' ' VAL . 11.5 t -53.27 -59.1 4.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 m -77.73 -41.55 37.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.993 0.902 . . . . 0.0 111.277 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.57 ' N ' ' O ' ' A' ' 37' ' ' VAL . 40.7 tp -55.17 -41.34 71.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.417 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 55.0 t -68.25 -3.85 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 120.912 0.387 . . . . 0.0 110.173 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.555 ' O ' ' C ' ' A' ' 44' ' ' ASP . 11.3 tp-100 -113.07 -29.56 7.28 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.035 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.555 ' C ' ' O ' ' A' ' 43' ' ' GLN . 46.7 t0 -17.81 -78.92 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.188 0.518 . . . . 0.0 111.341 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . 0.421 ' O ' ' C ' ' A' ' 46' ' ' LEU . 27.5 pt20 -142.89 0.5 1.23 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.554 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' A' ' 45' ' ' GLN . 5.5 tp 34.18 50.39 0.36 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.099 0.476 . . . . 0.0 110.722 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -56.21 -28.49 58.51 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.606 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.473 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 62.2 tttp -178.66 143.92 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.324 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -57.71 -38.82 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.694 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.473 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -68.44 -49.88 56.69 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.75 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 t -51.15 -65.08 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.08 -31.95 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.275 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.52 -42.52 98.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.101 0.476 . . . . 0.0 110.402 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -59.99 -40.28 88.61 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.134 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -66.63 -39.45 88.29 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.317 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.25 -48.88 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.66 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -57.15 -33.02 66.98 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.134 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 4.6 t-80 -74.54 -40.49 61.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.027 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.2 -29.24 63.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.067 0.46 . . . . 0.0 110.532 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -51.38 -30.65 19.63 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.75 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 7.5 pt-20 -60.72 -28.97 69.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.21 -59.67 2.74 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.368 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -42.98 66.71 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.348 0.594 . . . . 0.0 110.218 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -62.69 -39.02 92.66 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.2 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -63.6 -38.53 91.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.502 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.04 -50.89 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-O 121.336 0.588 . . . . 0.0 110.355 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -47.31 78.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.689 0.757 . . . . 0.0 111.304 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -56.16 -18.38 9.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.071 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.44 -18.41 52.62 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 . . . . . 0 C--N 1.33 -0.28 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.938 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.44 -0.963 0 CA-C-O 120.689 0.28 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.623 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 67.1 t -55.37 -49.86 90.07 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.826 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.623 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 6.7 Cg_endo -46.7 -20.6 1.1 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.831 1.687 . . . . 0.0 112.296 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -60.17 -42.54 95.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.151 0.501 . . . . 0.0 110.489 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.5 m-85 -58.52 -41.97 86.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.407 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 64.6 mt -67.65 -44.23 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 121.533 0.682 . . . . 0.0 110.464 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -51.61 -30.61 21.84 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.629 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.53 -32.05 70.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.115 0.483 . . . . 0.0 110.408 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.67 -39.35 70.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.293 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -55.85 -32.1 63.33 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.095 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -69.25 -30.61 68.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.522 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -67.87 -50.54 55.86 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 pt -72.73 -35.86 51.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 110.773 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -70.94 -54.34 11.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.43 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 28.8 ttp -99.03 -62.5 1.23 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' B' ' 20' ' ' MET . 11.1 t-20 78.6 49.81 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.244 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -51.06 -41.34 59.85 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 110.844 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -165.44 65.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.235 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -154.43 -131.97 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.179 0.514 . . . . 0.0 110.405 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -151.93 -175.59 5.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.46 0.648 . . . . 0.0 109.996 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -80.02 -104.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.95 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.42 ' C ' ' H ' ' B' ' 29' ' ' ALA . 15.8 tt -63.11 -37.12 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.243 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -63.13 -3.52 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.477 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.42 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.54 -46.52 83.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.407 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -63.96 -43.17 96.59 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.176 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.574 ' N ' ' SD ' ' B' ' 30' ' ' MET . 22.5 t-20 -52.48 -53.65 42.91 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.769 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 8.3 t -64.22 -53.51 48.11 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.823 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -59.22 -49.44 77.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.514 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.3 t80 -56.92 -47.24 81.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.821 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -65.06 -31.35 72.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.507 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.4 t -68.8 -42.85 76.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.646 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.11 -63.68 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.764 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.409 ' CG2' ' N ' ' B' ' 39' ' ' SER . 26.7 m -48.83 -44.46 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.41 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' SER . . . . . 0.467 ' HG ' ' N ' ' B' ' 40' ' ' THR . 62.9 p -60.7 -40.23 91.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.412 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.467 ' N ' ' HG ' ' B' ' 39' ' ' SER . 96.7 m -69.4 -46.76 66.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.121 0.486 . . . . 0.0 110.677 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' B' ' 44' ' ' ASP . 93.3 mt -60.35 -30.06 69.3 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.409 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -89.16 -39.69 12.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.154 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -69.38 -13.66 62.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' B' ' 45' ' ' GLN . 71.8 m-20 -146.45 166.74 25.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.346 0.593 . . . . 0.0 109.564 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 15.5 tt0 79.22 -77.99 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.71 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 24.6 mt 41.11 37.88 0.64 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.017 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.1 t -72.34 -32.22 66.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -170.41 132.2 0.98 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.611 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.23 -40.67 59.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.786 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.49 95.97 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.46 -44.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.569 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -79.22 -44.96 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.246 0.546 . . . . 0.0 110.683 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.4 tp -57.06 -57.02 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.823 -178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 0.2 OUTLIER -50.9 -34.59 29.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.257 0.551 . . . . 0.0 110.502 -179.309 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt85 -71.81 -41.87 67.74 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.978 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.3 -53.42 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.523 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -58.19 -37.8 75.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.473 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 4.4 m-70 -73.41 -38.95 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.38 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 40.7 tp -55.64 -30.11 60.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.567 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -52.33 -28.28 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -59.62 -32.27 70.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.571 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -55.61 7.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.521 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -42.67 62.32 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.265 0.555 . . . . 0.0 110.397 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -63.92 -39.65 94.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.415 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.84 -38.25 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.468 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.8 t -62.14 -47.93 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' B' ' 70' ' ' GLU . 0.0 OUTLIER -66.04 -40.79 91.26 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 122.014 0.911 . . . . 0.0 111.296 -179.278 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -49.8 -25.79 3.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.312 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.84 -20.38 55.93 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' B' ' 67' ' ' LYS . 55.4 mm-40 . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 0.0 110.057 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 120.612 0.244 . . . . 0.0 110.64 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.604 ' CG1' ' HE2' ' A' ' 58' ' ' HIS . 2.6 t -53.69 -55.21 37.77 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.043 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 77.6 Cg_exo -34.94 -25.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.391 2.06 . . . . 0.0 112.933 -179.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.569 ' N ' ' O ' ' A' ' 7' ' ' VAL . 82.9 t80 -56.37 -40.16 74.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.457 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.2 m-85 -61.82 -45.66 92.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.563 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.11 -43.68 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.427 0.632 . . . . 0.0 110.552 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -48.63 -23.74 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.397 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -74.18 -35.33 63.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.172 0.511 . . . . 0.0 110.632 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.1 mt -68.28 -39.41 82.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.574 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -57.88 -40.09 79.43 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.595 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -65.95 -31.04 71.72 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -67.15 -52.39 42.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.093 0.473 . . . . 0.0 110.97 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 pt -72.82 -42.86 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.576 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -62.07 -54.41 41.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.432 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 44.1 mtt -99.34 -139.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -170.3 49.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.232 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' OG ' ' A' ' 23' ' ' SER . 65.3 tt0 -58.12 -45.52 87.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.494 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 22' ' ' GLN . 2.3 m 174.5 72.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.325 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.76 -136.77 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.115 0.483 . . . . 0.0 110.301 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -145.18 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.307 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.455 ' HZ2' ' CD ' ' A' ' 70' ' ' GLU . 63.7 tttm -96.18 -108.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.357 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.599 ' O ' ' SD ' ' A' ' 30' ' ' MET . 10.3 tp -55.85 -36.75 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.01 0.433 . . . . 0.0 110.52 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -81.42 20.51 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.526 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.72 -52.8 26.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.49 . . . . 0.0 110.754 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.599 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.88 -32.92 72.34 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.249 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.517 ' N ' ' SD ' ' A' ' 30' ' ' MET . 51.3 t30 -51.68 -48.79 63.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.472 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.6 t -67.9 -52.88 31.27 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.744 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.457 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 67.5 t80 -60.67 -48.06 83.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.325 0.583 . . . . 0.0 110.936 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.498 ' N ' ' O ' ' A' ' 30' ' ' MET . 54.4 t80 -55.18 -54.81 38.64 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.997 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.34 -35.63 76.1 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.438 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 40' ' ' THR . 37.5 t -63.04 -44.64 95.33 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.392 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.83 -56.6 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.5 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 90.5 t -54.79 -49.09 71.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.36 -178.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -60.34 -45.22 94.21 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.307 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 36' ' ' SER . 78.3 m -61.13 -48.78 80.03 Favored 'General case' 0 C--N 1.328 -0.37 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.544 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.86 -41.27 91.87 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.15 0.5 . . . . 0.0 110.743 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.598 ' CG1' HE22 ' B' ' 57' ' ' GLN . 60.2 t -86.16 26.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.23 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -162.32 10.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -151.15 17.98 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.186 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -147.79 -79.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.669 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.9 mt 48.46 45.75 20.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.856 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -85.61 -27.15 25.64 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.465 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 tptm -173.02 132.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.975 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.44 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 8.5 m120 -51.19 -45.79 61.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.513 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.6 -46.79 88.92 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.968 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.4 t -56.32 -46.3 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.084 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . 0.503 ' O ' HG12 ' A' ' 56' ' ' ILE . 34.3 m -78.48 -49.92 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-O 121.736 0.779 . . . . 0.0 110.333 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 49' ' ' ASN . 9.0 tt -52.77 -59.97 3.83 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.937 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -49.22 -34.77 15.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.342 0.592 . . . . 0.0 110.196 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.2 -38.77 91.5 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.962 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 52' ' ' VAL . 16.3 mm -65.52 -51.03 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.449 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -58.85 -40.7 85.06 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.506 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.604 ' HE2' ' CG1' ' A' ' 7' ' ' VAL . 0.2 OUTLIER -72.62 -47.63 46.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.144 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.4 ' N ' ' ND1' ' A' ' 58' ' ' HIS . 37.6 tp -55.89 -33.69 64.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -56.76 -34.7 67.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.151 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.509 ' O ' ' ND2' ' A' ' 64' ' ' ASN . 4.7 pt-20 -52.84 -30.49 33.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.335 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.82 -42.0 35.22 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.553 0.692 . . . . 0.0 110.909 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.1 OUTLIER -56.17 -47.49 78.15 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.163 -179.471 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.517 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 0.7 OUTLIER -73.4 -22.59 60.21 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.003 0.43 . . . . 0.0 110.199 -179.246 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.22 -47.53 70.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.619 0.723 . . . . 0.0 111.348 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.429 ' CG1' ' N ' ' A' ' 67' ' ' LYS . 0.8 OUTLIER -56.77 -40.79 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.12 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.429 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 21.1 mtmt -67.86 -45.89 73.27 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.015 0.912 . . . . 0.0 111.127 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.66 -32.24 63.06 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.963 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.83 -14.28 79.9 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.455 ' CD ' ' HZ2' ' A' ' 26' ' ' LYS . 5.9 mm-40 . . . . . 0 N--CA 1.469 0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.42 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--O 1.232 0.132 0 CA-C-O 121.312 0.577 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.589 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.2 t -67.01 -39.86 24.95 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.135 178.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.589 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 76.7 Cg_exo -50.42 -26.75 16.82 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.89 1.727 . . . . 0.0 112.154 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.6 -40.76 92.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.426 0.631 . . . . 0.0 110.517 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.76 -41.78 87.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.487 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 56.2 mt -67.44 -44.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 CA-C-O 121.292 0.568 . . . . 0.0 110.267 -179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -49.18 -27.67 3.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.59 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 61.6 t-20 -74.23 -35.11 63.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.593 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -57.29 -40.17 77.22 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.09 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -65.8 -35.91 82.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.282 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . 0.439 ' O ' ' OD1' ' B' ' 21' ' ' ASN . 7.5 m-70 -65.96 -48.74 70.32 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.561 -0.455 . . . . 0.0 110.742 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -74.77 -33.12 30.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.0 110.694 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.19 -56.61 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.073 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' MET . . . . . 0.436 ' C ' ' ND2' ' B' ' 21' ' ' ASN . 47.6 mtt -87.28 -56.27 3.44 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.998 0.428 . . . . 0.0 110.617 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' B' ' 17' ' ' HIS . 3.7 m-80 73.58 46.19 0.22 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.026 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -39.95 -64.54 0.48 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.127 0.489 . . . . 0.0 111.02 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -140.62 3.44 1.88 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.768 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 20.9 tp10 -86.99 -131.85 0.06 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.125 0.488 . . . . 0.0 110.335 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -156.43 -158.13 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.336 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -95.47 -101.87 0.16 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.514 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' ILE . . . . . 0.422 HG23 HD12 ' B' ' 27' ' ' ILE . 44.3 mm -62.64 -37.26 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.43 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -69.89 2.55 3.34 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.536 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.74 -50.36 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.038 0.447 . . . . 0.0 111.087 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' MET . . . . . 0.562 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.11 -42.61 99.4 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.995 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . 0.562 ' N ' ' SD ' ' B' ' 30' ' ' MET . 44.9 t30 -50.6 -51.52 47.76 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.523 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 70.3 p -63.63 -51.56 64.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.591 179.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 43.2 t80 -65.09 -20.4 66.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' TYR . . . . . 0.562 ' N ' ' O ' ' B' ' 30' ' ' MET . 52.9 t80 -72.97 -53.87 10.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.062 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' CZ ' ' A' ' 34' ' ' TYR . 19.7 mmm180 -72.51 -18.32 61.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.821 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.0 t -68.92 -51.64 37.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.947 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' VAL . . . . . 0.442 ' CG2' ' N ' ' B' ' 38' ' ' VAL . 10.2 m -77.4 -44.72 30.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . 0.442 ' N ' ' CG2' ' B' ' 37' ' ' VAL . 71.0 t -53.71 -49.45 57.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.382 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 36.8 t -64.44 -25.74 68.14 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.864 0.364 . . . . 0.0 110.348 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' THR . . . . . 0.546 ' O ' ' N ' ' B' ' 44' ' ' ASP . 35.5 m -83.13 -50.52 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.554 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.02 -42.24 99.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.921 0.391 . . . . 0.0 110.827 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.5 t -68.47 -17.7 22.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.415 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -108.0 -19.25 13.57 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.048 0.451 . . . . 0.0 110.794 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' B' ' 40' ' ' THR . 37.6 t70 -90.5 -25.54 20.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.394 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -117.62 160.56 21.08 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.308 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -168.74 31.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.9 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 69.1 m -67.09 -41.19 86.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 110.902 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -174.08 142.93 0.88 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.265 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -51.49 -34.85 37.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.741 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' ALA . . . . . 0.444 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -75.51 -50.97 14.08 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.858 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -50.67 -43.23 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.698 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 23.0 m -75.15 -38.01 41.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.07 0.462 . . . . 0.0 110.285 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 65.7 tp -57.97 -36.27 72.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.573 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' LYS . . . . . 0.417 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 57.6 mtpt -57.33 -41.57 80.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.549 -179.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -65.63 -41.36 92.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.117 0.484 . . . . 0.0 110.449 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 21.9 mm -65.33 -50.5 72.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.856 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' GLN . . . . . 0.598 HE22 ' CG1' ' A' ' 42' ' ' VAL . 92.4 mm-40 -57.53 -39.42 76.56 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.311 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 52.8 m170 -65.85 -44.97 83.86 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.161 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.7 tp -53.57 -27.78 28.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.099 0.476 . . . . 0.0 111.016 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -52.52 -36.7 55.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.94 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.78 -31.66 71.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.477 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.98 -58.88 4.09 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.124 0.488 . . . . 0.0 110.813 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -40.19 61.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.353 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -66.66 -39.06 88.03 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.595 0.712 . . . . 0.0 110.319 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.7 mmtp -62.67 -36.8 84.06 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.305 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.4 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 82.2 t -63.8 -42.15 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-O 121.378 0.608 . . . . 0.0 110.264 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -67.18 -45.12 77.92 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.693 0.759 . . . . 0.0 111.488 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 51.7 ttt85 -88.71 1.49 55.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.103 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -108.67 -34.37 2.65 Favored Glycine 0 N--CA 1.474 1.226 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . 0.4 ' CG ' ' O ' ' B' ' 66' ' ' VAL . 1.5 pp20? . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.549 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.5 p -74.21 97.21 2.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.443 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.444 ' C ' ' H ' ' A' ' 5' ' ' PHE . 15.6 pt-20 -169.47 142.55 2.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.64 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.5 mt 58.08 7.78 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.487 ' CE2' ' OG ' ' A' ' 6' ' ' SER . 51.2 p90 -68.77 -34.45 75.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.487 ' OG ' ' CE2' ' A' ' 5' ' ' PHE . 0.9 OUTLIER -75.39 132.17 40.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.217 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -67.52 -41.63 32.46 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.943 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 59.1 Cg_exo -49.58 -24.84 9.96 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 C-N-CA 121.727 1.618 . . . . 0.0 111.915 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.59 -40.92 89.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.022 0.439 . . . . 0.0 110.362 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.467 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.6 m-85 -59.31 -42.38 91.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.232 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -65.88 -43.93 92.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.025 0.441 . . . . 0.0 110.421 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -50.84 -29.74 12.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.55 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -69.87 -35.73 74.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 110.57 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 42.2 mt -67.36 -38.53 84.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.693 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -55.91 -36.22 67.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' A' ' 20' ' ' MET . 65.9 tt0 -69.4 -36.69 76.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.5 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -60.88 -50.86 71.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.1 pt -72.07 -43.65 66.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.155 0.502 . . . . 0.0 110.942 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 50.5 tp10 -66.53 -51.74 53.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.391 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.401 ' N ' ' O ' ' A' ' 16' ' ' GLN . 36.1 mtt -104.51 -157.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 0.0 109.856 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.515 ' C ' ' H ' ' A' ' 23' ' ' SER . 61.4 t30 -142.77 62.58 1.4 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.455 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.447 ' O ' ' OG ' ' A' ' 23' ' ' SER . 6.1 tp-100 -73.01 39.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.528 0.68 . . . . 0.0 110.87 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.515 ' H ' ' C ' ' A' ' 21' ' ' ASN . 5.0 p 75.76 50.86 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.402 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 12.6 tp10 -143.62 -137.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.718 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -151.78 -164.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.373 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -84.25 -105.42 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.467 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.473 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.3 mt -62.21 -41.79 92.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -57.61 -6.03 0.44 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.457 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.473 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -61.2 -45.12 95.89 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.185 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.6 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -63.42 -45.46 90.85 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.216 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.587 ' N ' ' SD ' ' A' ' 30' ' ' MET . 55.4 t30 -53.47 -49.72 66.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.047 -0.661 . . . . 0.0 110.65 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 77.0 p -63.33 -50.39 70.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.03 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.467 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 48.2 t80 -69.33 -22.07 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.746 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 30' ' ' MET . 40.2 t80 -74.81 -56.65 4.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.304 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.402 ' O ' ' OG ' ' A' ' 39' ' ' SER . 6.7 ptm85 -60.22 -25.25 65.48 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 120.984 0.421 . . . . 0.0 110.325 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.8 t -72.31 -45.99 57.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.865 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -66.68 -63.03 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.494 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 20.0 m -46.33 -40.49 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.523 -179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 35' ' ' ARG . 37.6 m -59.2 -39.64 83.29 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.2 m -74.42 -44.56 51.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.572 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.446 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 91.0 mt -56.51 -22.93 36.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.604 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.8 t -92.32 -28.34 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.594 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -90.37 -38.33 13.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.39 0.614 . . . . 0.0 110.813 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.451 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 26.2 p-10 -42.55 -59.4 1.9 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.986 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.432 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 13.3 pt20 -167.76 124.21 1.1 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.557 0.694 . . . . 0.0 110.395 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mp -94.7 51.72 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.378 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t -60.37 -31.33 70.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.221 0.534 . . . . 0.0 110.374 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -169.65 128.1 0.94 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 8.0 p30 -49.31 -33.3 12.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.179 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -71.93 -49.37 38.23 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.785 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.1 t -46.9 -38.68 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.37 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.21 -34.56 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.267 0.556 . . . . 0.0 111.099 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -62.82 -46.46 87.84 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.026 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -40.44 94.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.008 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -65.98 -39.79 90.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.283 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 86.6 mt -66.27 -46.24 87.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -58.1 -34.95 70.74 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -69.82 -42.21 73.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.16 -29.49 45.71 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.549 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -52.62 -29.91 28.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.543 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -63.45 -32.95 74.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.142 0.496 . . . . 0.0 110.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.41 -58.1 4.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.765 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.529 ' OH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -52.02 -43.41 63.69 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 110.071 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -64.29 -33.73 76.49 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.386 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -64.2 -39.22 93.53 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.575 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.25 -51.33 72.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.394 0.616 . . . . 0.0 110.435 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -65.32 -45.97 82.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.842 0.829 . . . . 0.0 111.333 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -54.42 -25.42 24.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.127 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.12 -12.72 82.96 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -87.4 -164.9 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 0.0 110.408 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.0 p -148.4 54.11 1.01 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.811 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 57.85 22.15 8.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.233 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.86 98.51 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.353 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -179.14 43.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.438 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 64.22 81.03 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -54.8 123.42 13.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.001 0.429 . . . . 0.0 110.416 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.457 ' O ' ' CG ' ' A' ' 77' ' ' HIS . 53.3 t-80 -84.74 23.53 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.444 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 54.39 77.84 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.625 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -149.96 139.99 22.02 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.682 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.532 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.521 ' SD ' ' N ' ' B' ' 1' ' ' MET . 1.9 mpt? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -79.0 -54.25 6.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.313 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 50.75 91.43 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.112 0.482 . . . . 0.0 110.601 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.521 ' C ' ' H ' ' B' ' 6' ' ' SER . 1.5 tp -168.91 -158.23 0.2 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.221 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 48.4 t80 68.85 -44.01 0.52 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.648 0.737 . . . . 0.0 110.491 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.521 ' H ' ' C ' ' B' ' 4' ' ' LEU . 1.4 m -64.88 130.77 44.68 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.417 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 74.4 t -57.49 -49.72 92.23 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.971 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 8.7 Cg_endo -47.44 -23.81 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.349 1.366 . . . . 0.0 112.279 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -63.62 -42.56 98.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.089 0.471 . . . . 0.0 110.651 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.478 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.71 -43.91 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.366 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 67.5 mt -69.18 -44.01 81.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.2 0.524 . . . . 0.0 110.569 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -50.72 -26.78 5.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.337 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -72.67 -31.79 65.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.893 0.378 . . . . 0.0 110.278 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.98 -36.17 69.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.529 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -55.82 -39.37 71.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.989 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -65.64 -36.39 83.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -62.84 -51.41 67.14 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.635 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.6 pt -73.02 -43.2 59.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.087 0.47 . . . . 0.0 110.811 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -64.97 -55.2 20.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.687 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 42.7 mtt -98.05 -145.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 p30 -170.63 46.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.153 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.425 ' O ' ' OG ' ' B' ' 23' ' ' SER . 85.7 mt-30 -55.01 -44.72 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.554 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.425 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 3.6 m -179.97 69.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.148 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -165.08 -134.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.32 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -156.94 -167.44 2.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.346 0.593 . . . . 0.0 110.014 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -83.23 -106.07 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.585 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.501 ' C ' ' H ' ' B' ' 29' ' ' ALA . 21.3 tt -63.0 -34.57 67.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -67.59 8.09 0.4 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.779 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.501 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.48 -45.25 39.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.679 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.536 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -60.9 -46.67 89.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.834 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.79 -46.14 67.49 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.516 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -67.56 -54.17 22.21 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.835 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.478 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -61.76 -46.17 90.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.252 0.548 . . . . 0.0 110.669 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' B' ' 30' ' ' MET . 68.5 t80 -55.98 -47.11 78.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.741 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.529 ' NH2' ' OH ' ' A' ' 63' ' ' TYR . 76.0 ttt180 -66.16 -34.22 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -62.33 -45.01 95.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 110.649 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 85.5 t -69.26 -44.87 80.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.501 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 65.5 t -51.25 -48.19 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.434 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 78.4 p -56.39 -43.05 78.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.473 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.43 ' O ' ' N ' ' B' ' 44' ' ' ASP . 95.8 m -64.38 -44.62 90.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.674 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 93.1 mt -60.85 -47.29 87.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.508 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.11 -40.84 86.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 110.369 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . 0.483 ' O ' ' C ' ' B' ' 44' ' ' ASP . 94.8 mt-30 -72.97 -32.39 65.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.151 0.5 . . . . 0.0 110.655 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 43' ' ' GLN . 67.0 t0 -28.5 -84.2 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.147 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . 0.51 ' O ' ' N ' ' B' ' 47' ' ' THR . 26.5 pt20 -162.78 9.76 0.06 Allowed 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.47 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' B' ' 45' ' ' GLN . 1.1 tt 26.03 42.0 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.031 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.51 ' N ' ' O ' ' B' ' 45' ' ' GLN . 5.2 t -60.05 -33.01 71.47 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.447 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -154.32 127.43 8.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.592 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -47.45 -33.53 6.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.9 -50.22 57.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.2 t -50.79 -46.46 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.318 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -76.22 -39.93 35.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.378 0.608 . . . . 0.0 111.406 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -66.56 -40.56 89.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.896 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.405 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 17.8 mtpp -58.18 -44.87 88.24 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.172 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -65.62 -34.94 79.39 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.977 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.2 mm -69.08 -48.19 70.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.419 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -59.58 -43.5 93.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.128 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 64.9 m-70 -69.86 -45.48 67.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.441 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 51.2 tp -51.57 -28.68 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.03 -29.37 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.394 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.02 -35.5 73.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.61 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.04 -49.39 37.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.773 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -55.48 -42.06 73.84 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.486 HD22 ' NH2' ' B' ' 68' ' ' ARG . 48.3 t30 -68.56 -36.84 79.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.281 0.562 . . . . 0.0 110.854 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -60.33 -41.37 93.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.46 -47.85 79.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.67 0.748 . . . . 0.0 110.608 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -44.61 94.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.926 0.87 . . . . 0.0 111.381 -179.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . 0.486 ' NH2' HD22 ' B' ' 64' ' ' ASN . 42.6 ttm180 -63.74 -21.14 66.26 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.964 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.48 -20.21 14.0 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -100.79 -5.7 25.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.666 0.269 . . . . 0.0 110.613 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 92.9 p -43.16 158.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.441 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -58.62 -53.79 54.33 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.451 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 11.3 mt -76.82 134.15 39.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.653 0.74 . . . . 0.0 110.43 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -143.74 153.79 42.79 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.508 1.147 . . . . 0.0 109.701 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -146.49 127.66 14.73 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.745 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.563 ' CD2' ' H ' ' B' ' 77' ' ' HIS . 84.6 t60 -169.76 -116.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.645 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.563 ' H ' ' CD2' ' B' ' 76' ' ' HIS . 78.3 t60 -159.86 5.93 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.343 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 51.56 -172.91 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.617 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -158.07 139.26 13.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.574 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.48 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.4 m -61.52 -40.23 93.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 56.75 71.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.395 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.587 ' O ' ' N ' ' A' ' 6' ' ' SER . 6.3 mp 50.38 -125.79 2.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.155 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.8 t80 59.25 -69.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.026 0.441 . . . . 0.0 110.59 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.587 ' N ' ' O ' ' A' ' 4' ' ' LEU . 0.3 OUTLIER -63.18 130.92 46.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.042 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.602 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.6 t -67.31 -39.3 19.77 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.051 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 60.7 Cg_exo -53.08 -25.97 30.88 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 121.834 1.689 . . . . 0.0 111.951 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -60.18 -43.19 96.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 0.0 110.422 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.474 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.3 m-85 -57.08 -40.46 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.08 -44.2 84.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.09 0.472 . . . . 0.0 110.352 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -51.13 -30.75 17.41 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.614 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -69.08 -32.07 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.501 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.21 -38.63 66.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.4 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -56.09 -34.01 65.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.105 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -67.77 -33.42 74.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.402 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -65.35 -51.42 60.63 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.785 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.16 -40.07 65.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.321 0.581 . . . . 0.0 110.782 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -67.83 -53.78 24.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.136 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.419 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 44.7 mtt -98.74 -65.0 0.99 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.091 0.472 . . . . 0.0 110.086 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 21.0 t30 80.99 47.91 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.878 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -53.27 -40.76 64.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.299 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.2 p -158.87 64.91 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -161.89 -132.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.334 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 64.5 m-20 -158.66 -172.03 3.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.36 0.6 . . . . 0.0 110.062 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -77.73 -104.62 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.593 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.584 ' C ' ' H ' ' A' ' 29' ' ' ALA . 16.2 tt -63.97 -36.02 75.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.046 0.451 . . . . 0.0 110.768 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -68.05 16.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.584 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.92 -44.99 21.46 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.246 0.546 . . . . 0.0 110.263 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.647 ' O ' ' N ' ' A' ' 34' ' ' TYR . 26.3 tpp -61.9 -48.59 79.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.957 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.495 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 62.6 t-20 -47.28 -53.23 14.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.724 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.1 m -62.1 -50.31 72.43 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.959 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.474 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 40.8 t80 -67.2 -21.97 65.75 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.647 ' N ' ' O ' ' A' ' 30' ' ' MET . 45.2 t80 -73.91 -60.33 2.31 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.342 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.426 ' O ' ' OG ' ' A' ' 39' ' ' SER . 16.7 ptm180 -61.16 -26.33 67.62 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.922 179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.406 ' O ' ' OG1' ' A' ' 40' ' ' THR . 42.2 t -66.23 -47.89 72.33 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.708 0.289 . . . . 0.0 110.491 -179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.6 -48.06 60.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.422 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.2 t -62.46 -53.96 40.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.716 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.426 ' OG ' ' O ' ' A' ' 35' ' ' ARG . 13.6 m -59.7 -18.39 42.02 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.36 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 36' ' ' SER . 23.0 m -87.51 -49.32 7.27 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.102 0.477 . . . . 0.0 111.078 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 43' ' ' GLN . 96.6 mt -70.81 -42.85 69.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.66 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.415 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 43.4 t -78.3 27.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.401 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.451 ' H ' ' C ' ' A' ' 41' ' ' LEU . 74.6 mt-30 -147.61 2.92 0.73 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.729 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 46' ' ' LEU . 38.5 t70 -150.37 168.09 25.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.133 0.492 . . . . 0.0 110.278 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 67.31 -64.86 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.504 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.1 mt 36.96 43.34 0.29 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.332 0.587 . . . . 0.0 111.183 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 t -76.53 -31.85 57.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.425 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -170.82 131.32 0.84 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.645 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -50.07 -37.69 34.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.626 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.87 -48.46 71.47 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.315 0.578 . . . . 0.0 110.555 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -53.39 -44.02 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.628 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.12 -36.63 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-O 121.012 0.434 . . . . 0.0 111.09 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.22 -47.66 83.45 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.71 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 15.5 pttp -50.2 -38.44 40.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.206 0.527 . . . . 0.0 110.21 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 mmm180 -64.55 -38.4 90.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.173 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.01 -51.12 73.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.302 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -53.58 -45.29 69.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.367 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.409 ' N ' ' HD1' ' A' ' 58' ' ' HIS . 2.2 m80 -65.08 -38.28 90.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.54 -30.43 53.93 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.172 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -61.41 -32.1 72.04 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.036 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -59.31 -40.46 86.32 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.199 0.524 . . . . 0.0 110.844 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.63 -49.27 33.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.237 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -49.75 -43.1 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.944 -179.279 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.572 ' ND2' ' NE ' ' A' ' 68' ' ' ARG . 1.7 t-20 -66.95 -35.84 80.87 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.333 0.587 . . . . 0.0 110.372 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 30.7 tptt -69.61 -41.43 75.72 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.507 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -46.19 96.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 122.12 0.962 . . . . 0.0 110.664 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.7 mmtm -66.84 -43.11 84.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.449 -179.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.572 ' NE ' ' ND2' ' A' ' 64' ' ' ASN . 78.0 mtm180 -81.51 -15.14 55.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.454 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -92.88 -37.76 5.66 Favored Glycine 0 N--CA 1.471 1.012 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -73.5 -35.27 65.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.055 0.455 . . . . 0.0 110.378 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.4 m -126.79 114.64 18.22 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.58 0.705 . . . . 0.0 110.472 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -81.0 -13.36 58.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.504 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 mt -72.41 -75.48 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.256 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 46.91 38.59 6.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.0 110.498 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -163.87 133.17 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.524 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -82.47 67.93 8.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.273 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -65.81 -45.97 80.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.623 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -79.8 158.53 26.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.364 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.437 ' O ' ' CG ' ' A' ' 80' ' ' HIS . 98.1 m-70 52.58 -165.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.675 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' A' ' 79' ' ' HIS . 71.3 m80 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 118.092 -0.956 . . . . 0.0 110.484 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ptt? . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 91.0 p -58.68 120.06 8.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.059 0.457 . . . . 0.0 110.505 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -84.75 167.4 16.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.314 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 mt 55.47 22.21 4.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.293 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -60.86 -47.61 85.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.282 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 3.4 m -79.42 119.31 22.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.295 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.503 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -56.44 -45.49 99.92 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.197 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 88.5 Cg_exo -45.78 -23.52 1.64 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.533 1.489 . . . . 0.0 112.615 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.91 -39.96 91.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.354 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -60.36 -42.35 95.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.347 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.33 -45.3 98.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.056 0.455 . . . . 0.0 110.437 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -48.61 -28.38 3.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.577 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -74.37 -39.76 62.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.6 mt -69.49 -46.22 67.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.329 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -62.79 -26.06 68.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.459 0.647 . . . . 0.0 110.519 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -63.45 -29.63 70.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.569 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.573 ' NE2' ' O ' ' B' ' 25' ' ' ASP . 82.8 t60 -81.84 -61.56 1.88 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.258 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 pt -50.5 -37.25 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-O 121.385 0.612 . . . . 0.0 110.359 -179.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -74.14 -55.5 6.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.662 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -101.52 -119.76 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.055 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.448 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 21.2 p-10 -176.42 74.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.258 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -79.89 -72.34 0.41 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.221 0.534 . . . . 0.0 110.245 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 28.5 p -172.99 85.19 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.359 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . 0.441 ' N ' ' CE1' ' B' ' 17' ' ' HIS . 9.4 tp10 -169.73 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.562 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . 0.573 ' O ' ' NE2' ' B' ' 17' ' ' HIS . 91.7 m-20 -135.36 -95.9 0.25 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.741 0.305 . . . . 0.0 110.339 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -163.13 -99.51 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.178 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.93 -40.59 89.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.131 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -71.18 -14.53 62.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.462 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.21 -40.4 5.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.76 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.558 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -66.17 -48.36 70.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.744 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.495 ' ND2' ' OD1' ' A' ' 31' ' ' ASN . 39.8 t-20 -57.1 -48.53 78.39 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.694 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 41.1 t -62.51 -44.72 95.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.347 0.594 . . . . 0.0 111.014 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -73.96 -46.75 42.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.869 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 50.5 t80 -49.15 -40.46 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.891 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.521 ' NH2' ' CG ' ' A' ' 34' ' ' TYR . 42.7 ttm180 -72.57 -30.22 64.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.088 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 12.5 t -61.56 -43.19 99.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 87.3 t -73.19 -43.73 56.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 110.577 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 88.6 t -54.71 -45.99 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.585 -179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 42.2 t -58.83 -41.62 87.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.381 . . . . 0.0 110.402 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 31.5 m -72.32 -46.03 57.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.207 0.527 . . . . 0.0 110.775 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.458 ' O ' ' OD1' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -53.33 -30.5 39.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.534 -179.451 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.9 t -90.71 -28.4 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.306 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -73.86 -22.4 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.48 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' B' ' 41' ' ' LEU . 44.9 p30 -79.99 -176.06 5.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.302 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -43.26 141.58 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.688 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -122.9 61.63 1.01 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.24 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.45 -31.54 72.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.936 179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -168.08 126.84 1.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.848 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.491 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 23.4 p30 -46.87 -28.46 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.491 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -73.59 -51.25 17.52 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.289 0.566 . . . . 0.0 110.555 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.9 t -49.22 -44.94 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.657 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.0 m -73.4 -35.71 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-O 121.193 0.521 . . . . 0.0 110.742 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.53 -27.97 68.18 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.537 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.485 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 55.8 mttp -53.84 -44.44 70.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.987 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -68.65 -38.89 80.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.483 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 32.0 mm -63.33 -52.61 56.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.298 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -57.35 -37.69 72.98 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.485 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 27.6 m-70 -74.82 -44.29 50.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.514 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 31.9 tp -55.35 -29.67 58.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.239 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.418 ' OD1' ' OH ' ' B' ' 34' ' ' TYR . 87.9 m-20 -51.58 -38.76 55.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.333 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.75 -30.34 32.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.463 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.44 -54.02 14.05 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.487 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -50.05 -39.07 40.81 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.268 0.556 . . . . 0.0 110.074 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.483 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 50.2 t30 -72.66 -38.83 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . 0.608 ' HZ3' ' NH2' ' B' ' 68' ' ' ARG . 46.5 mmtt -61.66 -39.57 91.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.343 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.1 t -60.3 -50.16 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.15 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 17.8 mtmt -72.72 -49.88 28.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.54 0.686 . . . . 0.0 111.661 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . 0.608 ' NH2' ' HZ3' ' B' ' 65' ' ' LYS . 68.8 ttp85 -57.14 -32.22 66.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.86 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.65 -12.72 84.21 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -103.88 -176.9 3.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.91 0.386 . . . . 0.0 110.559 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.494 ' O ' ' N ' ' B' ' 73' ' ' LEU . 76.7 p 48.77 -153.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.699 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttm 51.14 -87.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' B' ' 71' ' ' SER . 26.2 mt -79.71 -0.37 33.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.225 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.456 ' O ' ' O ' ' B' ' 75' ' ' HIS . 95.3 mt-10 55.18 9.69 0.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.046 0.451 . . . . 0.0 110.414 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.456 ' O ' ' O ' ' B' ' 74' ' ' GLU . 83.8 t60 58.12 145.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.643 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -91.28 140.28 29.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.951 0.405 . . . . 0.0 110.429 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 48.3 p-80 -147.59 2.8 0.73 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -65.43 -43.44 90.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -61.19 -41.5 96.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.442 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.576 -179.949 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 p 53.29 99.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.51 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -97.09 117.24 30.83 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.408 0.623 . . . . 0.0 110.158 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.09 3.7 1.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.507 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -62.29 -43.27 99.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 0.0 110.384 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -71.2 132.12 44.52 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.23 -179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.51 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -61.24 -43.75 91.09 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.6 Cg_exo -49.59 -27.46 14.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 121.104 1.203 . . . . 0.0 112.267 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.26 -42.45 99.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.527 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -58.61 -44.1 89.81 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 48.3 mt -67.44 -43.71 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.243 0.544 . . . . 0.0 110.595 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -51.94 -33.38 37.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.499 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -67.37 -32.06 72.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.077 0.465 . . . . 0.0 110.4 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.8 mt -71.41 -38.72 71.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.626 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -53.77 -34.37 58.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.046 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -66.8 -36.65 82.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.491 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -61.6 -51.91 66.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.652 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.42 -43.57 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.866 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -65.79 -51.87 55.43 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.472 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 34.9 mtt -104.5 -160.68 0.78 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.151 0.501 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -154.54 51.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.276 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -59.3 -50.56 73.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.962 0.41 . . . . 0.0 110.38 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 p -177.15 71.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.45 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -167.87 -132.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.307 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -155.44 -166.42 2.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.038 0.447 . . . . 0.0 110.406 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.92 -104.27 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.585 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.8 tt -63.41 -39.28 84.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 52.0 t-80 -63.39 10.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.159 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.585 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -76.93 -44.43 31.58 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.003 0.43 . . . . 0.0 110.638 178.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.522 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -62.86 -46.64 86.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.012 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' OD1' ' NH2' ' B' ' 35' ' ' ARG . 44.5 t30 -53.58 -48.97 68.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.641 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.4 p -64.77 -54.06 37.24 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.906 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -61.03 -42.72 99.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.316 0.579 . . . . 0.0 110.384 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.522 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.3 t80 -55.45 -48.06 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -75.56 -20.43 58.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.3 . . . . 0.0 110.471 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.9 t -68.22 -50.8 51.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.439 ' CG2' ' N ' ' A' ' 38' ' ' VAL . 4.7 m -74.82 -45.94 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.439 ' N ' ' CG2' ' A' ' 37' ' ' VAL . 55.2 t -56.45 -48.27 80.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.824 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -61.23 -42.26 98.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.4 m -69.31 -46.81 66.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.801 0.334 . . . . 0.0 110.743 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.433 ' O ' ' O ' ' A' ' 44' ' ' ASP . 82.5 mt -62.66 -30.37 71.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.37 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 74.7 t -85.32 -38.01 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.49 -6.44 19.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.252 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' CB ' ' A' ' 45' ' ' GLN . 54.5 p30 -149.05 165.86 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.901 0.381 . . . . 0.0 110.506 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.45 HE22 ' NH2' ' A' ' 55' ' ' ARG . 51.0 tt0 82.78 -73.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.499 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt 43.52 42.28 3.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.119 0.485 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.8 m -62.27 -37.8 86.85 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.433 0.635 . . . . 0.0 110.227 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.471 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 57.9 tttp -178.6 145.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.516 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -57.43 -40.65 78.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.662 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.471 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -66.36 -47.74 72.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.021 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.0 t -53.58 -65.21 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.229 -178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.7 -32.14 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.955 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -41.15 96.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.883 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 25.1 mtpp -59.67 -41.98 91.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.098 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.45 ' NH2' HE22 ' A' ' 45' ' ' GLN . 94.0 mtt180 -65.18 -41.83 94.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.056 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.7 -51.55 49.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.429 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.438 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 15.4 mm100 -56.95 -41.19 77.85 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 19.2 m-70 -71.06 -41.88 70.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.689 0.28 . . . . 0.0 110.364 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.47 -22.56 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.598 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 4.3 p-10 -57.41 -30.49 64.98 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.486 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.5 pt-20 -60.7 -33.64 73.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 0.0 110.257 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.11 -57.46 4.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.883 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.98 -39.21 25.71 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.45 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 52.4 t30 -70.87 -39.95 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.931 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -60.66 -46.82 88.86 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 84.3 t -54.83 -55.07 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.163 -0.615 . . . . 0.0 110.326 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -60.35 -46.22 90.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.177 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.0 tpt85 -58.25 -14.06 6.41 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.719 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.88 9.1 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 -54.41 -104.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.2 p -166.8 -128.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 pttm -160.04 83.65 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.34 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.2 tp -172.64 51.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.244 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -89.86 63.95 6.22 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.945 0.402 . . . . 0.0 110.208 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 58.85 77.78 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.446 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.5 m80 54.36 87.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.322 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' A' ' 79' ' ' HIS . 10.1 t-80 -75.55 107.53 7.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.964 0.412 . . . . 0.0 110.339 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -54.29 -76.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.569 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.476 ' O ' ' ND1' ' A' ' 77' ' ' HIS . 72.1 m80 -61.15 159.96 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.442 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 74.1 m80 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.464 -179.886 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mmt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -157.05 -6.27 0.1 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . 0.601 ' C ' ' H ' ' B' ' 5' ' ' PHE . 94.7 mt-10 -71.46 -120.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.121 0.486 . . . . 0.0 110.382 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 40.3 mt 61.79 -6.27 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.767 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . 0.601 ' H ' ' C ' ' B' ' 3' ' ' GLU . 43.1 m-85 -71.15 -33.9 70.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.257 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -74.12 133.11 42.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.1 t -72.43 -38.48 5.34 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-O 119.306 -0.378 . . . . 0.0 109.992 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 59.6 Cg_exo -53.48 -28.61 45.5 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.379 1.386 . . . . 0.0 111.806 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -60.64 -44.46 96.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.68 0.276 . . . . 0.0 110.352 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.466 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.1 m-85 -58.18 -37.53 74.93 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.147 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.68 -47.1 72.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.37 -25.91 6.87 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.525 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -70.31 -31.42 68.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.373 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.69 -39.74 66.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.685 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -32.83 68.09 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.041 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.426 ' CD ' ' NE2' ' B' ' 22' ' ' GLN . 48.3 tt0 -66.37 -30.65 71.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.573 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -69.16 -51.98 32.74 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.712 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 pt -72.81 -44.44 58.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 121.044 0.45 . . . . 0.0 110.709 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.71 -53.02 57.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.693 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.9 mmt -96.29 -147.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 109.874 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -171.21 45.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.013 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.426 ' NE2' ' CD ' ' B' ' 16' ' ' GLN . 50.2 mt-30 -54.85 -46.12 74.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.659 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t 178.52 68.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.445 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . 0.415 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 16.9 tp10 -160.9 -130.99 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.399 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -160.37 -171.81 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.362 0.601 . . . . 0.0 110.369 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -78.44 -106.45 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.132 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.525 ' C ' ' H ' ' B' ' 29' ' ' ALA . 20.0 tt -64.83 -32.79 59.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.615 0.245 . . . . 0.0 110.691 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.09 7.78 0.26 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.608 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.525 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.07 -43.0 36.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.267 0.556 . . . . 0.0 110.575 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.48 ' O ' ' N ' ' B' ' 34' ' ' TYR . 16.2 ptt? -59.45 -47.1 86.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.355 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.476 ' N ' ' CG ' ' B' ' 30' ' ' MET . 33.6 m120 -54.14 -43.41 70.51 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.501 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.415 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 78.3 p -70.65 -55.43 8.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.727 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.466 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 42.2 t80 -59.59 -46.15 89.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.216 0.531 . . . . 0.0 110.598 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.48 ' N ' ' O ' ' B' ' 30' ' ' MET . 59.4 t80 -55.77 -48.55 75.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.004 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.476 ' NH2' ' OD1' ' A' ' 31' ' ' ASN . 44.5 ttm180 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.393 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.5 t -70.04 -50.99 35.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.896 0.379 . . . . 0.0 110.488 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.0 t -68.18 -56.73 11.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.5 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 69.1 t -48.44 -49.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.328 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 71.3 m -57.81 -36.41 72.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.3 m -71.21 -49.99 37.73 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.949 0.404 . . . . 0.0 111.309 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.3 mt -53.23 -36.62 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.294 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.1 -38.63 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.411 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -115.93 78.16 1.16 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.407 0.622 . . . . 0.0 110.237 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -178.38 -69.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.765 0.793 . . . . 0.0 110.716 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 67.8 tp60 -86.34 -74.89 0.4 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.54 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tt 69.28 43.67 1.04 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.165 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -80.75 -27.69 36.73 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.334 0.587 . . . . 0.0 110.524 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -178.7 145.81 0.32 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.428 HD21 ' N ' ' A' ' 50' ' ' ALA . 18.3 p-10 -64.26 -45.03 89.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.56 -39.93 85.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.832 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 12.6 t -57.93 -62.11 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.845 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -54.19 -33.81 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.574 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.72 -60.63 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.689 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.456 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 16.8 ptpt -58.23 -35.59 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.929 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -62.91 -35.72 81.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.078 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 88.4 mt -71.23 -46.2 66.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.492 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -54.75 -25.37 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.14 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.456 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 50.8 m170 -70.2 -44.97 67.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.211 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -20.98 2.25 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.591 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -59.46 -45.31 91.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.178 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.14 -37.68 88.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.065 0.46 . . . . 0.0 110.654 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -53.89 11.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.913 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.03 -37.71 21.57 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.101 0.476 . . . . 0.0 109.773 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -65.6 -37.21 85.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.652 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 15.5 tptp -55.34 -39.57 70.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.717 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.24 -39.27 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-O 121.836 0.827 . . . . 0.0 110.515 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -64.91 -46.85 79.95 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.803 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -86.05 -12.24 50.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.336 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -92.57 -37.15 5.91 Favored Glycine 0 N--CA 1.476 1.364 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' B' ' 71' ' ' SER . 1.1 pp20? -67.34 -165.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.012 0.434 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.408 ' O ' ' OE2' ' B' ' 70' ' ' GLU . 31.3 t -44.5 109.21 0.14 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.194 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.8 tttt 179.61 12.08 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.38 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 75' ' ' HIS . 41.0 tp -173.82 -99.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 37.34 22.83 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.325 0.583 . . . . 0.0 111.182 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.633 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 0.0 OUTLIER -46.07 -87.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.429 -178.869 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.633 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 79.4 m80 -97.83 159.2 15.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -163.37 137.33 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.296 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -71.5 149.0 46.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.286 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -58.99 -42.57 90.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.454 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.1 p80 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.607 179.915 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.4 mtp . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 p -77.47 178.96 6.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.437 ' C ' ' H ' ' A' ' 5' ' ' PHE . 96.2 mt-10 -70.41 147.4 49.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.386 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.3 mt 53.65 11.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.437 ' H ' ' C ' ' A' ' 3' ' ' GLU . 73.1 t80 -61.24 -47.39 86.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.384 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -91.56 127.48 37.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.407 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.464 ' CG1' ' NE2' ' A' ' 58' ' ' HIS . 1.0 OUTLIER -58.52 -46.52 99.6 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.748 179.001 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 99.1 Cg_exo -40.66 -29.78 0.46 Allowed 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 121.248 1.299 . . . . 0.0 112.764 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -59.15 -48.36 81.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.183 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -47.15 85.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.763 0.316 . . . . 0.0 110.26 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.9 mt -61.14 -47.44 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 121.324 0.583 . . . . 0.0 110.41 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -46.27 -32.55 3.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.745 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -60.85 -35.75 77.36 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.2 mp -76.52 -40.06 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.782 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -62.59 -35.43 79.5 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.867 0.365 . . . . 0.0 110.256 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.48 -29.94 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.584 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -72.68 -56.04 5.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.422 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 2.1 pt -67.38 -42.33 87.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.335 0.588 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.8 tt0 -62.24 -53.42 55.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.639 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.3 mtt -98.58 -132.4 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -170.35 50.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.449 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -58.1 -50.58 72.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.596 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.0 p -174.19 21.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -134.9 175.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.368 1.08 . . . . 0.0 109.806 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -112.23 -126.5 0.28 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.364 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -113.42 -87.93 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.663 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.4 mm -68.12 -24.17 29.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.683 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -84.67 -9.7 58.0 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.376 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 -51.23 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.828 0.347 . . . . 0.0 110.496 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.556 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -64.14 -41.06 97.35 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.556 ' N ' ' SD ' ' A' ' 30' ' ' MET . 50.3 t30 -56.62 -51.78 67.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.354 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.9 t -65.27 -51.36 61.3 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.773 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -60.71 -53.55 56.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.46 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.456 ' N ' ' O ' ' A' ' 30' ' ' MET . 38.3 t80 -54.84 -48.75 72.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.903 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.3 tpt180 -60.28 -40.03 88.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.918 0.389 . . . . 0.0 110.183 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.1 m -64.8 -41.14 96.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.0 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.23 -60.44 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.63 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.432 ' CG1' ' N ' ' A' ' 39' ' ' SER . 8.3 p -52.15 -43.42 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.252 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.432 ' N ' ' CG1' ' A' ' 38' ' ' VAL . 69.6 m -62.53 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -57.94 -43.99 86.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.375 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.21 -45.63 62.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.259 0.552 . . . . 0.0 110.631 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.45 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 61.0 t -82.33 26.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.29 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -159.98 19.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.319 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -168.77 21.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.231 . . . . 0.0 110.467 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -172.3 62.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.488 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 30.8 mt -100.66 50.52 0.88 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.369 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.2 t -72.31 -34.68 68.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.385 0.612 . . . . 0.0 110.436 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -163.92 132.07 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.439 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 19.4 p30 -48.59 -36.63 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.605 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.439 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -69.18 -53.24 21.05 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 111.03 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.6 t -48.24 -44.31 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.564 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -75.8 -40.16 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.985 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 14.2 mt -59.34 -40.5 86.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.548 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -52.82 -50.2 64.14 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.531 -0.467 . . . . 0.0 109.921 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -62.38 -43.16 99.49 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.259 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.5 mt -64.01 -55.64 20.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.638 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -50.92 -41.26 58.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.167 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.464 ' NE2' ' CG1' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -73.05 -43.45 61.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.902 179.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 41.3 tp -56.89 -29.63 63.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.782 -178.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -52.79 -52.56 56.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.246 -0.582 . . . . 0.0 110.377 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -51.39 -29.49 15.81 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.758 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.34 -62.26 1.57 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.764 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -43.36 64.69 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -61.61 -25.77 67.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.25 -179.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.559 ' NZ ' ' NH2' ' A' ' 68' ' ' ARG . 31.2 tptt -75.1 -32.74 61.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.622 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.5 t -67.21 -52.4 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-O 121.367 0.604 . . . . 0.0 110.465 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -47.17 79.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.84 0.828 . . . . 0.0 111.6 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.559 ' NH2' ' NZ ' ' A' ' 65' ' ' LYS . 70.7 ttp85 -57.17 -24.74 56.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.981 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -84.22 -16.21 67.5 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -92.66 175.82 6.67 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.167 0.508 . . . . 0.0 110.492 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.5 m 46.53 -172.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.398 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -141.86 -65.95 0.41 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.534 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' O ' ' CD2' ' A' ' 75' ' ' HIS . 4.3 mm? -53.3 -57.68 9.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 58.55 48.5 11.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.315 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.494 ' CD2' ' O ' ' A' ' 73' ' ' LEU . 89.6 m-70 -148.3 163.12 38.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.488 0.661 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 76' ' ' HIS . 18.8 t-80 -132.59 45.86 2.7 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.699 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.0 m-70 -79.18 54.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.385 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -61.35 -45.9 92.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.446 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -134.77 -47.23 0.74 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.728 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.9 t60 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.508 -179.82 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 79.2 p -156.42 129.0 7.68 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.589 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -93.98 78.58 4.11 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.373 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 54.4 mt -69.91 -21.79 63.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.321 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -59.48 -42.46 92.13 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.271 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -86.15 126.71 34.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.507 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.4 t -60.58 -41.98 85.86 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.662 -0.685 . . . . 0.0 109.837 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.507 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 79.9 Cg_exo -47.21 -34.27 17.61 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 121.123 1.215 . . . . 0.0 112.223 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -55.45 -41.95 73.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.183 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.405 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -62.53 -44.83 95.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.383 -179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.414 ' O ' ' N ' ' B' ' 14' ' ' LEU . 30.5 mt -60.61 -48.29 89.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.456 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -45.31 -32.4 1.99 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.66 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -59.14 -35.31 73.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.475 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 7.0 mp -73.19 -38.22 66.22 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.775 0.321 . . . . 0.0 110.307 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.95 -34.41 77.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.043 0.449 . . . . 0.0 110.315 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -64.51 -28.85 69.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.626 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -72.18 -53.63 12.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.858 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 6.2 pt -70.63 -43.04 77.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.313 0.577 . . . . 0.0 110.729 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.09 -39.55 82.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.204 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -126.0 -135.26 0.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.907 0.385 . . . . 0.0 110.552 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -173.3 55.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.268 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -60.07 -44.82 94.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.285 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t 175.33 71.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -166.25 -124.76 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.798 0.332 . . . . 0.0 110.393 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -156.94 -168.71 2.73 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.312 0.577 . . . . 0.0 110.006 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -89.8 -98.63 0.1 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.37 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.426 ' C ' ' H ' ' B' ' 29' ' ' ALA . 3.1 mm -61.5 -44.42 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.811 -179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -57.58 -8.35 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.582 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.426 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -55.66 -48.34 75.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.532 179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.427 ' O ' ' N ' ' B' ' 34' ' ' TYR . 2.3 ptm -67.15 -50.31 61.71 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.457 ' OD1' ' NH1' ' A' ' 35' ' ' ARG . 91.5 m-20 -56.89 -44.76 82.62 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.508 -179.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.434 ' HG ' ' H ' ' B' ' 33' ' ' TYR . 78.1 p -69.96 -51.23 34.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.805 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.434 ' H ' ' HG ' ' B' ' 32' ' ' SER . 44.5 t80 -63.63 -51.65 64.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.827 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.427 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.0 t80 -52.66 -44.44 66.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.022 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -69.33 -36.7 77.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.573 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 45.1 m -60.55 -39.12 86.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.407 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.74 -54.97 13.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.32 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 49.1 t -48.49 -38.21 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.501 -179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.442 ' O ' ' N ' ' B' ' 43' ' ' GLN . 77.6 p -64.95 -47.11 78.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.087 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -65.57 -46.12 80.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.445 0.641 . . . . 0.0 111.234 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -62.9 -34.99 78.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.651 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 79.2 t -85.59 -37.99 12.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' B' ' 39' ' ' SER . 47.8 tt0 -75.93 -0.5 21.66 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.661 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' B' ' 41' ' ' LEU . 46.6 m-20 -157.13 171.54 20.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 52.24 42.36 30.77 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.578 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.98 43.63 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.6 t -65.4 -43.21 91.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.446 0.641 . . . . 0.0 110.557 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -158.22 131.47 7.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.643 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -46.54 -42.78 16.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.267 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.28 -50.84 70.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.934 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 28.5 t -51.0 -46.85 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.451 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.3 m -76.3 -45.09 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 121.594 0.711 . . . . 0.0 111.146 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -56.84 -42.69 80.11 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.606 -178.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -53.48 -45.33 69.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.184 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.401 HH21 ' HD1' ' B' ' 58' ' ' HIS . 0.0 OUTLIER -60.45 -40.13 90.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 179.56 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 26.2 mm -65.43 -52.3 53.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.445 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -52.7 -47.25 67.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.185 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.401 ' HD1' HH21 ' B' ' 55' ' ' ARG . 54.5 m170 -67.09 -44.88 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.6 tp -52.17 -27.49 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.319 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -52.16 -45.11 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.348 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -50.07 -28.45 7.16 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.708 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.87 -63.49 1.05 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.705 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -47.47 -46.35 26.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.38 0.609 . . . . 0.0 110.083 -179.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.469 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.2 t-20 -59.22 -36.75 75.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.055 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.1 tptp -60.81 -34.29 74.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.439 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 60.0 t -69.92 -51.24 41.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.523 0.678 . . . . 0.0 110.497 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' B' ' 69' ' ' GLY . 5.4 mmmt -72.92 -21.75 60.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.564 1.173 . . . . 0.0 112.359 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -38.54 -27.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.685 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' B' ' 67' ' ' LYS . . . 155.27 66.67 0.01 OUTLIER Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.439 ' CG ' ' O ' ' B' ' 66' ' ' VAL . 60.3 mm-40 -112.4 -26.68 8.6 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 64.2 m -81.05 -8.12 59.7 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.021 0.439 . . . . 0.0 110.763 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' B' ' 74' ' ' GLU . 64.4 mttp -81.06 96.96 7.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.301 0.572 . . . . 0.0 110.079 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.445 ' O ' ' O ' ' B' ' 74' ' ' GLU . 0.5 OUTLIER -68.62 72.44 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.272 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' B' ' 73' ' ' LEU . 90.6 mt-10 -52.0 -105.26 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.648 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.417 ' CE1' ' CE1' ' B' ' 76' ' ' HIS . 78.5 t60 -139.59 111.16 7.15 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.482 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.471 ' N ' ' HD1' ' B' ' 76' ' ' HIS . 1.7 m80 52.6 176.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.61 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -63.62 -41.05 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.35 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.612 ' CD2' ' HD1' ' B' ' 79' ' ' HIS . 85.6 t60 -145.73 -83.58 0.13 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.554 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . 0.612 ' HD1' ' CD2' ' B' ' 78' ' ' HIS . 77.9 m80 -157.52 -40.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.601 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . 0.557 ' N ' ' HD1' ' B' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.626 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mmm . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.4 t -60.58 -43.28 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -51.68 147.34 6.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.588 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tt 74.65 -59.24 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.643 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -59.56 -41.16 89.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.49 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -69.46 142.06 53.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.351 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.547 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 4.3 t -67.13 -42.4 40.43 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.107 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 68.2 Cg_exo -49.23 -24.37 8.12 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 121.529 1.486 . . . . 0.0 112.125 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -70.14 -41.29 74.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.183 0.516 . . . . 0.0 110.449 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -62.81 -47.29 84.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.274 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.11 -42.97 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.342 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -49.27 -25.15 2.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.717 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -75.63 -38.03 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.077 0.465 . . . . 0.0 110.599 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 43.6 mt -63.71 -39.33 94.03 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.548 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -55.32 -36.74 66.54 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.236 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.6 tt0 -65.77 -32.42 73.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.517 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.69 -52.28 46.49 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.806 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 pt -73.96 -45.94 47.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.848 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 tm-20 -66.84 -50.37 62.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.144 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.426 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 4.1 tpp -94.79 -165.11 1.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.696 0.76 . . . . 0.0 109.934 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -154.56 44.11 0.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.257 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -56.98 -53.36 58.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.177 0.513 . . . . 0.0 110.286 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -174.73 70.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.385 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.401 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 14.2 tp10 -164.71 -135.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.964 0.411 . . . . 0.0 110.204 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -156.57 -165.93 2.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.46 0.648 . . . . 0.0 109.928 -179.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.511 ' HZ3' ' H ' ' A' ' 27' ' ' ILE . 17.9 ttpp -85.0 -103.23 0.05 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.451 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.566 ' C ' ' H ' ' A' ' 29' ' ' ALA . 3.3 mm -63.02 -38.99 83.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -64.54 8.34 0.12 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.804 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.566 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.46 -48.47 22.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.458 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.527 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.45 -43.94 96.33 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.277 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' ' SD ' ' A' ' 30' ' ' MET . 13.5 m120 -52.42 -46.18 66.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.323 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.401 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 79.6 p -70.74 -54.88 10.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.806 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 44.5 t80 -58.88 -49.26 78.43 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.243 0.544 . . . . 0.0 110.669 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 30' ' ' MET . 72.0 t80 -58.07 -48.47 80.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.904 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -66.74 -36.27 82.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.958 0.409 . . . . 0.0 110.41 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -62.77 -44.2 96.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.634 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -71.55 -51.83 30.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.374 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 88.3 t -51.19 -48.81 31.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.246 -179.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -60.45 -39.61 88.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.2 m -65.7 -48.19 72.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.271 0.557 . . . . 0.0 110.863 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 44' ' ' ASP . 99.1 mt -56.91 -33.36 66.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.758 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -87.34 -38.47 12.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.309 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -53.17 -12.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.664 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.447 ' O ' ' O ' ' A' ' 41' ' ' LEU . 3.4 m-20 -173.01 -172.88 0.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.178 0.513 . . . . 0.0 110.003 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 58.04 33.22 22.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.96 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.63 44.33 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.452 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -64.31 -29.65 70.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.587 . . . . 0.0 110.702 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.429 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 87.8 tttt -168.22 131.3 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.713 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.639 HD21 ' N ' ' A' ' 50' ' ' ALA . 0.4 OUTLIER -48.42 -38.22 19.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.524 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.639 ' N ' HD21 ' A' ' 49' ' ' ASN . . . -67.05 -49.06 66.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.803 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -51.83 -45.11 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.374 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.4 m -77.79 -43.72 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.835 0.826 . . . . 0.0 111.116 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 tt -63.69 -41.73 98.1 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.264 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -53.11 -40.01 63.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.987 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.435 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 53.1 mtp180 -67.51 -35.45 79.14 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.446 HG12 ' O ' ' A' ' 52' ' ' VAL . 40.9 mm -65.05 -51.11 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.58 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 98.1 mm-40 -57.65 -39.35 76.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.435 ' ND1' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -72.81 -46.37 53.49 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.089 0.471 . . . . 0.0 110.167 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' N ' ' CG ' ' A' ' 58' ' ' HIS . 29.5 tp -55.71 -25.02 38.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.631 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.39 -34.92 73.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.987 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.28 -32.24 72.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.955 0.407 . . . . 0.0 110.477 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.98 -54.27 13.99 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.81 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.421 ' HH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.22 -46.71 69.21 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.966 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -62.49 -34.5 76.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.266 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -63.12 -37.85 88.87 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.404 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.8 t -57.86 -53.64 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.197 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -64.69 -44.27 90.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.746 0.784 . . . . 0.0 111.4 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -53.87 -27.86 32.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.019 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -86.09 -15.05 65.6 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -95.52 174.41 7.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.106 0.479 . . . . 0.0 110.229 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.8 p -157.71 163.77 37.82 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.176 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -159.52 -19.4 0.07 Allowed 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.249 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -169.69 159.53 8.24 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.375 0.607 . . . . 0.0 110.353 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -128.69 -29.72 2.35 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.43 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -64.96 -170.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.783 0.325 . . . . 0.0 110.494 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.605 ' ND1' ' H ' ' A' ' 78' ' ' HIS . 33.0 t-80 -147.79 142.14 26.29 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.143 0.497 . . . . 0.0 110.634 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -74.2 -16.96 60.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.452 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.605 ' H ' ' ND1' ' A' ' 76' ' ' HIS . 81.1 t60 53.61 98.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.551 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -65.23 130.57 43.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.469 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 61.8 t-80 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.798 -179.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 52.9 m -156.28 165.46 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.548 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 56.3 59.13 3.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.379 0.609 . . . . 0.0 110.843 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.56 ' O ' ' N ' ' B' ' 6' ' ' SER . 4.0 mm? -66.24 -38.98 89.16 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.912 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . 0.553 ' O ' ' CB ' ' B' ' 6' ' ' SER . 98.7 m-85 -46.59 88.7 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 122.256 1.027 . . . . 0.0 110.088 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.56 ' N ' ' O ' ' B' ' 4' ' ' LEU . 8.4 p 144.59 69.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.448 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.462 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.8 t -35.77 -54.66 1.31 Allowed Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.701 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.462 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 12.6 Cg_endo -51.42 -21.59 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 121.305 1.337 . . . . 0.0 112.331 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . 0.496 ' N ' ' O ' ' B' ' 6' ' ' SER . 16.8 t80 -64.98 -47.54 77.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.338 0.589 . . . . 0.0 110.713 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.44 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.9 OUTLIER -72.95 -47.54 44.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.359 -179.472 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.5 mt -58.79 -42.15 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.159 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -47.42 -26.03 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.665 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . 0.637 ' ND2' ' HE2' ' B' ' 17' ' ' HIS . 54.3 t30 -74.08 -43.64 56.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.508 . . . . 0.0 110.464 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.96 -36.42 77.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.896 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . 0.45 ' NZ ' ' OE1' ' B' ' 19' ' ' GLU . 26.3 ttpp -58.78 -46.81 86.67 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.01 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.56 -29.05 69.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.578 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.637 ' HE2' ' ND2' ' B' ' 13' ' ' ASN . 5.7 m-70 -68.19 -52.7 31.47 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.686 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 9.4 pt -74.78 -46.2 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.014 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . 0.45 ' OE1' ' NZ ' ' B' ' 15' ' ' LYS . 82.7 tt0 -56.0 -54.66 42.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.553 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 45.7 mtt -97.87 -137.53 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.866 0.365 . . . . 0.0 110.039 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -171.38 43.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.305 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -55.99 -47.84 76.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.3 p -173.9 68.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.318 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -166.9 -137.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.927 0.394 . . . . 0.0 110.422 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -156.27 -156.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.397 0.618 . . . . 0.0 109.891 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -93.81 -103.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.978 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.496 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.1 mm -62.18 -39.36 83.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -67.77 7.56 0.49 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.653 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.75 -48.39 22.0 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.05 0.453 . . . . 0.0 110.651 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.631 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -64.68 -46.05 84.03 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.298 179.51 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.555 ' N ' ' SD ' ' B' ' 30' ' ' MET . 26.0 t-20 -51.18 -52.86 40.22 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.064 -0.655 . . . . 0.0 110.912 -178.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 10.8 t -60.64 -46.84 88.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.791 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.44 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 47.1 t80 -72.79 -20.03 61.24 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.623 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.631 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.0 t80 -73.79 -55.43 6.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.289 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.421 ' NH2' ' HH ' ' A' ' 63' ' ' TYR . 9.4 ptm180 -65.37 -26.59 68.08 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.415 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' SER . . . . . 0.417 ' O ' ' OG1' ' B' ' 40' ' ' THR . 82.8 p -66.57 -46.56 75.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.35 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 55.8 t -70.18 -49.63 53.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.149 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.49 -49.28 84.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.361 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -65.5 -17.86 64.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 110.633 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.417 ' OG1' ' O ' ' B' ' 36' ' ' SER . 27.7 m -87.32 -52.02 5.62 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.84 179.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.439 ' C ' ' H ' ' B' ' 43' ' ' GLN . 97.8 mt -66.99 -40.92 87.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.609 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.427 ' O ' ' CG1' ' B' ' 42' ' ' VAL . 61.7 t -77.89 18.4 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.048 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . 0.439 ' H ' ' C ' ' B' ' 41' ' ' LEU . 75.6 mt-30 -145.13 -1.45 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.727 0.299 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -114.2 -30.61 6.58 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.491 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -152.24 86.83 1.3 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.936 0.398 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.13 40.08 1.74 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.506 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -62.81 -17.94 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 110.401 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.635 ' O ' HG22 ' B' ' 51' ' ' VAL . 16.9 tptm -168.19 122.72 0.94 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.184 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -54.43 -15.98 2.01 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.049 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' B' ' 53' ' ' LEU . . . -80.31 -59.62 2.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.012 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . 0.635 HG22 ' O ' ' B' ' 48' ' ' LYS . 23.1 m -45.93 -36.74 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.58 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 32.7 m -77.53 -31.95 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.724 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' B' ' 50' ' ' ALA . 50.1 tp -58.05 -37.91 75.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.948 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.428 ' C ' ' HE ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -58.89 -45.48 90.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.386 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.546 ' HE ' ' N ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -64.3 -44.23 92.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.777 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.38 -51.54 69.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.581 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -56.52 -44.45 80.8 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.544 ' ND1' HH21 ' B' ' 55' ' ' ARG . 47.1 m170 -68.3 -42.09 79.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 tp -52.15 -26.03 10.39 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.741 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.39 -30.13 66.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -61.43 -36.75 81.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.889 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.43 -58.88 3.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -44.22 61.45 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.026 0.441 . . . . 0.0 110.014 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.62 -40.92 98.49 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.306 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 57.2 tttm -66.96 -35.32 79.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.173 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.66 -49.99 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.446 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.27 69.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.798 0.809 . . . . 0.0 111.582 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -63.84 -37.52 87.68 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.027 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.55 -26.9 72.2 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -86.22 -46.72 10.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.612 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 13.9 m -61.43 164.09 6.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.466 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 53.91 -137.57 1.2 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.391 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.495 ' O ' ' N ' ' B' ' 75' ' ' HIS . 10.1 mp 41.33 -105.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.573 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' B' ' 73' ' ' LEU . 80.7 mm-40 33.34 -93.05 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.827 0.823 . . . . 0.0 110.524 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.66 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 43.2 t-80 58.46 -176.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.199 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.66 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 96.5 m-70 -135.42 42.46 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.29 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.619 ' N ' ' HD1' ' B' ' 75' ' ' HIS . 84.5 t60 -79.38 77.66 5.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.956 0.407 . . . . 0.0 110.023 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' B' ' 80' ' ' HIS . 73.9 m80 52.62 71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 86.2 t60 53.9 -86.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.566 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . 0.474 ' N ' ' O ' ' B' ' 78' ' ' HIS . 45.9 p-80 . . . . . 0 C--O 1.221 -0.437 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.68 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.8 p -160.48 164.11 32.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.177 0.513 . . . . 0.0 110.477 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -135.51 76.85 1.64 Allowed 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.622 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pp -171.44 3.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -61.01 -42.06 97.73 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.363 0.601 . . . . 0.0 110.317 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t -52.52 127.67 23.41 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.466 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.539 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.5 t -51.69 -54.2 42.41 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.539 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 7.9 Cg_endo -46.99 -16.65 0.32 Allowed 'Trans proline' 0 C--N 1.306 -1.698 0 C-N-CA 122.045 1.83 . . . . 0.0 112.099 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -70.65 -47.13 61.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.114 0.483 . . . . 0.0 110.691 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.466 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.0 m-85 -62.97 -42.51 99.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.465 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 93.9 mt -65.43 -43.62 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.467 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -51.37 -26.27 7.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.436 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -72.95 -36.63 67.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.123 0.487 . . . . 0.0 110.597 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.41 -38.88 85.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.452 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.34 -37.0 74.27 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.105 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' MET . 59.2 tt0 -65.71 -30.27 70.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.651 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -68.63 -52.75 27.98 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.68 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.54 -44.59 53.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 0.0 110.965 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -67.79 -39.45 84.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.216 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.412 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 6.0 ttm -111.66 -163.21 0.84 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.529 0.68 . . . . 0.0 110.247 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -156.79 46.29 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.267 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -58.2 -49.46 76.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.176 0.512 . . . . 0.0 110.387 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -176.21 69.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -165.45 -133.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.272 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -157.0 -165.38 1.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.246 0.546 . . . . 0.0 110.124 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -81.37 -108.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.258 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' A' ' 29' ' ' ALA . 5.8 tp -63.87 -35.71 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -63.53 5.83 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.577 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.1 -43.15 54.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.5 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -62.6 -44.27 96.73 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.737 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' A' ' 30' ' ' MET . 29.9 m120 -52.49 -54.8 27.63 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.648 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.0 m -62.05 -55.25 31.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.466 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 55.1 t80 -57.23 -41.0 78.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.187 0.518 . . . . 0.0 110.596 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.517 ' N ' ' O ' ' A' ' 30' ' ' MET . 26.2 t80 -63.67 -52.37 60.99 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.989 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.505 HH12 ' CE ' ' B' ' 30' ' ' MET . 82.4 mtp180 -65.86 -27.14 68.01 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.608 ' HG ' ' N ' ' A' ' 37' ' ' VAL . 68.2 p -72.0 -44.25 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.74 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.608 ' N ' ' HG ' ' A' ' 36' ' ' SER . 17.1 t -66.87 -63.11 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.763 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.437 ' CG2' ' N ' ' A' ' 39' ' ' SER . 22.8 m -49.13 -45.84 17.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.338 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.437 ' N ' ' CG2' ' A' ' 38' ' ' VAL . 64.7 p -58.42 -43.62 88.76 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.202 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.485 ' O ' ' N ' ' A' ' 44' ' ' ASP . 97.0 m -65.49 -46.84 78.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 110.65 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.65 -43.49 96.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.579 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 32.1 t -85.7 29.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.357 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 61.1 tp60 -160.68 -14.27 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.7 0.286 . . . . 0.0 110.796 -179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' THR . 31.4 t70 -114.37 -34.4 5.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.415 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -96.08 -79.59 0.44 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.543 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.4 mt 52.49 43.27 31.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.977 0.418 . . . . 0.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -88.65 -26.42 21.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.519 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -172.51 134.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.904 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 91.6 m-20 -54.72 -41.32 70.19 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.47 87.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.016 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.08 -43.59 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.523 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 56' ' ' ILE . 34.1 m -76.5 -36.85 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.406 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -59.94 -54.74 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.857 -177.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -38.71 92.01 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.428 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -65.49 -42.1 92.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.496 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 52' ' ' VAL . 71.3 mt -65.47 -45.79 91.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.497 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -54.63 -36.5 64.59 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.439 ' ND1' ' OE2' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -66.47 -35.53 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.35 -40.24 95.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.522 -177.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -50.21 -29.88 10.36 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE2' ' ND1' ' A' ' 58' ' ' HIS . 4.9 pt-20 -60.34 -34.4 73.79 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.418 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.74 -49.26 26.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.954 0.407 . . . . 0.0 110.738 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.86 -38.44 64.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.909 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -69.32 -36.86 77.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.62 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -60.19 -39.27 85.92 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.227 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.83 -47.32 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 122.041 0.924 . . . . 0.0 110.414 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -61.46 -41.42 97.2 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.47 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 55.9 ttt85 -67.53 -14.21 62.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.108 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.59 -63.01 1.12 Allowed Glycine 0 N--CA 1.461 0.363 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.633 ' CG ' ' H ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -50.17 -99.71 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.506 0.193 . . . . 0.0 110.742 -179.907 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.633 ' H ' ' CG ' ' A' ' 70' ' ' GLU . 41.8 t -65.32 90.79 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.398 0.618 . . . . 0.0 110.347 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -60.35 -38.86 85.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.254 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.547 ' O ' ' N ' ' A' ' 75' ' ' HIS . 8.1 tp -141.8 -52.98 0.43 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.771 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.58 67.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.682 . . . . 0.0 110.763 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 73' ' ' LEU . 85.7 t60 -106.21 59.75 0.65 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.3 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 54.33 79.89 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.727 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -77.56 -160.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.329 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 71.9 m80 54.82 173.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.471 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -73.73 151.26 40.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.518 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.735 -179.78 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mmm . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 43.7 t -67.44 147.66 52.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.521 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -164.67 144.72 7.47 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.356 0.598 . . . . 0.0 110.444 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.59 -29.03 66.12 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.089 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -54.19 -41.31 68.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.211 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -69.12 125.82 27.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.117 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.559 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.4 OUTLIER -64.93 -42.53 63.18 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 70.9 Cg_exo -51.95 -22.25 13.88 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 121.896 1.73 . . . . 0.0 111.984 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -61.91 -42.39 99.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.464 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -64.4 -38.12 89.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.192 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.9 mt -64.23 -44.88 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -49.89 -22.54 1.54 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.573 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -69.7 -40.03 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.328 0.585 . . . . 0.0 110.553 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.04 -36.11 66.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -58.11 -32.83 68.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.438 ' O ' ' N ' ' B' ' 20' ' ' MET . 57.4 tt0 -75.13 -30.05 60.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.457 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -67.09 -51.44 54.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 0.0 110.661 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.93 -41.82 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.497 0.665 . . . . 0.0 110.757 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -73.68 -51.72 15.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.661 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.438 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.0 tpp -90.2 -66.57 0.91 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.11 0.481 . . . . 0.0 110.583 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 t30 76.71 43.07 0.14 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.797 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -55.25 -35.95 65.53 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.332 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 90.8 p -163.45 63.57 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.651 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -161.15 -132.82 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.39 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -153.21 -170.31 3.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.342 0.591 . . . . 0.0 110.316 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -80.96 -108.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.442 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 21.0 tt -62.22 -38.47 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.34 -179.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 80.7 m80 -58.48 -12.44 3.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.541 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.12 -41.62 49.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.522 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.559 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -65.38 -51.52 59.82 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.251 179.083 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.537 ' N ' ' SD ' ' B' ' 30' ' ' MET . 42.4 t30 -53.33 -37.28 62.16 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.243 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 79.5 p -76.73 -52.36 9.74 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.026 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.464 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 85.0 t80 -65.84 -38.16 88.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.398 0.618 . . . . 0.0 110.921 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.559 ' N ' ' O ' ' B' ' 30' ' ' MET . 58.6 t80 -62.08 -56.63 16.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.423 -179.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -60.47 -25.52 66.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.16 179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.19 -45.88 53.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.726 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -67.45 -64.76 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.362 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.402 ' CG2' ' N ' ' B' ' 39' ' ' SER . 19.4 m -45.41 -41.32 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.474 -179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.402 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 14.0 t -60.26 -42.08 94.58 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -67.27 -46.12 74.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.797 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.4 mm? -59.84 -37.0 78.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.215 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.1 t -80.77 -38.14 16.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.365 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.38 -11.69 7.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.431 ' O ' ' O ' ' B' ' 41' ' ' LEU . 79.2 m-20 -143.55 161.79 37.55 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 121.318 0.58 . . . . 0.0 110.229 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 73.47 162.19 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.997 179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 178.26 25.02 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -63.02 -32.07 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.113 0.482 . . . . 0.0 110.404 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -170.67 123.73 0.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.786 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.627 HD21 ' N ' ' B' ' 50' ' ' ALA . 0.5 OUTLIER -47.26 -29.71 2.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.437 179.447 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.627 ' N ' HD21 ' B' ' 49' ' ' ASN . . . -73.8 -47.04 41.6 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.19 0.519 . . . . 0.0 110.694 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.1 t -50.22 -42.68 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.304 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.3 m -76.14 -33.47 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.11 -40.85 98.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.43 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 36.8 pttt -53.0 -39.01 62.79 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -66.53 -40.75 89.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.132 -179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.72 -50.94 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.297 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -57.88 -39.21 77.28 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.43 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 6.1 m-70 -74.03 -38.13 64.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.109 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 tp -56.07 -30.59 62.2 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.582 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.468 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 91.9 m-20 -52.47 -28.5 20.5 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.495 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -62.1 -35.27 78.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.799 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.01 -53.29 13.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.688 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -45.82 72.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.018 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 75.6 m-20 -63.45 -36.27 83.18 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.002 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . 0.505 ' HZ2' HH21 ' B' ' 68' ' ' ARG . 34.5 tptt -61.37 -37.8 84.68 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.56 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.9 t -60.5 -58.22 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.284 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -62.13 -47.04 86.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.66 0.743 . . . . 0.0 111.636 -179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . 0.505 HH21 ' HZ2' ' B' ' 65' ' ' LYS . 55.5 ttp180 -56.03 -15.89 4.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.08 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.81 -16.33 36.55 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -94.32 -58.44 2.21 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.656 0.265 . . . . 0.0 110.54 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -97.93 83.35 3.13 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.471 0.653 . . . . 0.0 110.474 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -171.08 -54.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.027 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 54.5 tp -124.14 132.23 53.62 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.58 0.705 . . . . 0.0 110.562 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -102.39 -6.79 22.6 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.507 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 37.5 m-70 58.8 15.92 4.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.999 0.428 . . . . 0.0 110.561 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 48.3 m170 47.91 -163.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.702 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -66.94 93.63 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.841 0.353 . . . . 0.0 110.444 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -71.49 125.96 28.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.404 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 -74.64 -76.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.567 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . 0.417 ' H ' ' CD2' ' B' ' 80' ' ' HIS . 9.7 p80 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.553 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.5 mtp . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -63.93 -59.04 5.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.578 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 49.71 86.91 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.53 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 59.0 mt -66.62 128.64 37.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.115 0.483 . . . . 0.0 110.3 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -98.01 53.55 1.09 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.241 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.644 ' HG ' ' H ' ' A' ' 7' ' ' VAL . 30.7 t 50.77 -136.51 1.26 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.561 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.644 ' H ' ' HG ' ' A' ' 6' ' ' SER . 3.0 t -58.79 -55.17 48.88 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-O 118.814 -0.612 . . . . 0.0 109.787 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 71.6 Cg_exo -34.04 -31.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.843 0 C-N-CA 121.633 1.555 . . . . 0.0 113.092 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 7' ' ' VAL . 53.3 t80 -63.65 -43.97 95.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.589 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.457 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.4 m-85 -61.59 -43.16 99.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.143 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -64.91 -49.01 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.418 0.628 . . . . 0.0 110.668 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -50.69 -25.11 3.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.401 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -73.65 -38.37 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.03 0.443 . . . . 0.0 110.258 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.5 mt -63.26 -39.43 94.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.435 -179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -59.89 -39.61 85.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.101 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -59.08 -26.8 64.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.531 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -73.97 -52.71 11.95 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.113 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -74.18 -43.66 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.222 0.534 . . . . 0.0 110.706 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 67.5 mm-40 -67.33 -48.18 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.355 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 5.8 ttm -96.79 -161.03 0.84 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.373 0.606 . . . . 0.0 109.939 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -157.46 36.68 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.238 -179.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -53.22 -66.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.997 0.427 . . . . 0.0 110.437 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.1 m -163.59 69.6 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.521 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -159.94 -137.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.49 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -154.97 -168.67 2.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.262 0.553 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -81.21 -105.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.335 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.553 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.6 tt -65.29 -35.93 76.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.455 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.689 ' NE2' HD21 ' A' ' 31' ' ' ASN . 49.3 t-80 -65.44 8.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.749 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -74.43 -43.88 54.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.59 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.3 -44.5 94.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.286 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.689 HD21 ' NE2' ' A' ' 28' ' ' HIS . 42.4 t30 -52.05 -51.34 58.16 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.955 -0.698 . . . . 0.0 110.676 -178.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.0 t -65.16 -54.18 33.67 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.068 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.457 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 54.1 t80 -59.29 -43.64 92.54 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.322 0.582 . . . . 0.0 110.729 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.449 ' N ' ' O ' ' A' ' 30' ' ' MET . 34.4 t80 -59.57 -56.79 17.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.175 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.608 ' NH2' ' CE2' ' B' ' 63' ' ' TYR . 72.8 ttt-85 -61.17 -28.34 69.06 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.166 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 69.2 m -68.69 -44.71 73.4 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.428 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.4 t -70.89 -55.71 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.285 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -52.93 -45.93 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.382 -179.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.2 m -64.82 -21.86 66.87 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.383 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -86.29 -49.85 7.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.342 0.591 . . . . 0.0 111.018 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.407 ' C ' ' H ' ' A' ' 43' ' ' GLN . 86.5 mt -66.17 -43.58 86.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.8 t -81.04 24.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.52 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.407 ' H ' ' C ' ' A' ' 41' ' ' LEU . 51.0 tt0 -140.53 1.06 1.71 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.445 -179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 46' ' ' LEU . 44.9 t0 -146.97 167.33 24.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.318 0.58 . . . . 0.0 110.266 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 65.96 -64.4 0.2 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.55 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 44' ' ' ASP . 18.9 mt 37.66 50.19 1.14 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.193 0.52 . . . . 0.0 111.05 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -78.28 -30.45 48.49 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.694 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -174.2 132.76 0.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.365 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.658 ' H ' HD21 ' A' ' 49' ' ' ASN . 0.8 OUTLIER -50.26 -41.17 49.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.375 0.607 . . . . 0.0 110.833 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.83 -47.58 82.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.683 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 48.2 t -58.56 -47.42 88.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.269 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.0 t -67.89 -42.48 85.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.36 0.6 . . . . 0.0 110.627 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.9 tp -60.17 -43.14 96.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.399 -178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.77 -38.04 60.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.172 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 60.4 mtp180 -67.44 -41.44 84.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.243 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 33.7 mm -62.96 -51.1 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.478 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -54.98 -43.84 73.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.673 0.273 . . . . 0.0 110.382 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -68.56 -35.25 77.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.249 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.19 -39.78 76.08 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.281 -179.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -51.19 -26.88 7.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.886 0.374 . . . . 0.0 110.387 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.41 -38.03 88.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.8 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -53.39 11.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.911 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.01 -42.21 48.81 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.42 0.628 . . . . 0.0 109.935 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -63.95 -30.67 71.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.216 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -63.69 -36.86 85.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.488 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 66.5 t -66.17 -43.92 91.8 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-O 121.933 0.873 . . . . 0.0 110.579 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -63.12 -44.95 94.18 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.109 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -72.14 -12.33 61.14 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.048 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -93.73 -33.28 7.14 Favored Glycine 0 N--CA 1.475 1.299 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -90.84 -33.71 15.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 110.359 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.9 p -140.53 167.41 22.23 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.372 0.606 . . . . 0.0 110.75 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -109.0 -13.57 14.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.693 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 tt 55.74 67.47 1.0 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.224 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -83.39 -88.15 0.1 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.175 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -151.95 147.4 26.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.718 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -147.49 -29.66 0.34 Allowed 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.591 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -65.24 86.99 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.879 0.371 . . . . 0.0 110.503 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.417 ' O ' ' CG ' ' A' ' 79' ' ' HIS . 98.9 m-70 -56.99 -75.8 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.54 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 78' ' ' HIS . 76.6 m80 -155.1 -49.4 0.09 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.584 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.518 -179.962 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' SER . . . . . 0.485 ' O ' ' O ' ' B' ' 3' ' ' GLU . 70.7 m -68.63 -113.74 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.438 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . 0.485 ' O ' ' O ' ' B' ' 2' ' ' SER . 97.7 mt-10 56.72 130.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 10.3 mp 52.85 11.01 0.17 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . 0.445 ' H ' ' C ' ' B' ' 3' ' ' GLU . 75.6 t80 -60.86 -46.24 91.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.492 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -75.22 132.64 41.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.533 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 38.3 t -65.8 -40.89 43.14 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.026 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 71.4 Cg_exo -50.23 -13.26 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 120.821 1.014 . . . . 0.0 112.198 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -73.11 -41.03 64.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 110.59 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.435 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -73.21 -46.72 48.81 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.542 -179.809 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.82 -45.86 97.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.647 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -50.19 -20.97 1.15 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.257 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -66.91 -36.53 82.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 0.0 110.519 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -74.18 -35.94 64.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.621 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.38 -40.54 68.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.44 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.3 tt0 -65.44 -35.29 80.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.253 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -63.19 -51.84 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.8 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -73.83 -45.81 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.106 0.479 . . . . 0.0 110.747 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -67.09 -51.06 59.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.355 -179.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.431 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.1 tpp -91.59 -156.28 0.45 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.5 0.667 . . . . 0.0 110.004 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -164.74 41.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.202 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -57.33 -39.34 75.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.592 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t 174.45 70.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.54 -136.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.44 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -157.16 -159.91 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 110.39 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.415 ' HZ1' ' CD1' ' B' ' 27' ' ' ILE . 63.2 tttm -91.0 -104.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.291 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.527 ' C ' ' H ' ' B' ' 29' ' ' ALA . 39.0 mm -62.47 -41.37 91.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.287 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' B' ' 28' ' ' HIS . 61.4 t-80 -62.08 2.18 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.693 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.527 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.52 -46.53 54.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.61 0.243 . . . . 0.0 110.663 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.496 ' CE ' ' ND2' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -60.13 -42.64 95.26 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.174 179.494 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' CE ' ' B' ' 30' ' ' MET . 30.7 m120 -52.02 -50.84 60.6 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.788 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 72.1 m -66.52 -56.16 12.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.962 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.435 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 80.7 t80 -56.58 -46.23 80.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.053 0.454 . . . . 0.0 110.605 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.479 ' N ' ' O ' ' B' ' 30' ' ' MET . 79.5 t80 -57.87 -47.32 83.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.986 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 74.7 ttt-85 -71.16 -24.88 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.337 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 36.4 p -72.59 -47.83 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.46 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.78 -56.95 9.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.591 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -48.98 -45.54 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 69.3 m -60.7 -34.82 74.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.771 0.319 . . . . 0.0 110.304 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.8 m -74.15 -47.84 33.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.196 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.5 -36.12 66.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.21 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -81.55 -31.79 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.294 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -124.12 82.73 2.06 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.549 0.69 . . . . 0.0 110.016 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -170.94 -67.03 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.944 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -102.06 -45.51 5.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.933 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 12.2 mt 44.04 60.82 2.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -92.84 -26.58 17.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.367 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.51 138.41 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.65 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -55.73 -43.1 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.162 0.506 . . . . 0.0 110.549 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.39 -43.06 97.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.92 -35.52 65.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.069 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 49.0 t -78.2 -44.44 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.425 0.631 . . . . 0.0 111.028 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.86 -51.99 66.97 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.857 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptmm? -57.08 -39.88 75.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.264 0.554 . . . . 0.0 110.214 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.36 -37.88 88.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.336 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.8 mt -66.91 -46.53 84.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.37 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.87 -37.44 68.81 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.532 ' HE2' ' CG1' ' B' ' 7' ' ' VAL . 1.4 t-80 -73.31 -37.35 66.2 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.92 -39.96 96.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.78 -178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.403 ' O ' ' OD1' ' B' ' 64' ' ' ASN . 50.0 m-20 -50.43 -29.72 10.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.443 ' OE1' ' CD2' ' B' ' 58' ' ' HIS . 3.3 pt-20 -59.86 -33.07 71.31 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.669 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.24 -51.19 26.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.61 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.608 ' CE2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -53.34 -44.13 68.23 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.108 0.48 . . . . 0.0 109.766 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' B' ' 60' ' ' ASP . 22.6 m120 -64.48 -32.44 74.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.1 tptp -60.39 -37.01 79.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.587 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.78 -46.29 94.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.724 0.773 . . . . 0.0 110.318 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.15 -47.19 52.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 122.183 0.992 . . . . 0.0 111.901 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -60.51 -26.1 66.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.139 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.22 -63.7 1.57 Allowed Glycine 0 C--N 1.33 0.213 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' B' ' 71' ' ' SER . 2.1 pp20? -52.91 -173.65 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.719 0.295 . . . . 0.0 110.506 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.477 ' N ' ' OE1' ' B' ' 70' ' ' GLU . 1.0 OUTLIER 77.42 176.81 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.201 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' B' ' 74' ' ' GLU . 51.6 mtmt 52.21 69.32 0.69 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.607 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.59 ' O ' ' N ' ' B' ' 75' ' ' HIS . 0.9 OUTLIER 34.56 29.57 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.33 0.586 . . . . 0.0 111.338 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' B' ' 72' ' ' LYS . 3.2 pt-20 -27.91 85.25 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.988 0.899 . . . . 0.0 111.193 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.636 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 57.9 t60 -109.62 -133.02 0.33 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.496 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.636 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 36.7 m80 -91.31 112.45 24.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.278 0.561 . . . . 0.0 110.624 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.448 ' O ' ' CG ' ' B' ' 78' ' ' HIS . 75.9 m80 -60.16 -41.97 93.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.385 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.448 ' CG ' ' O ' ' B' ' 77' ' ' HIS . 77.6 m80 -155.45 125.08 6.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.404 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -77.28 114.26 15.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.392 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.4 m -87.43 2.87 49.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.415 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.464 ' C ' ' H ' ' A' ' 5' ' ' PHE . 74.2 mt-10 -72.76 58.33 0.45 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.954 0.406 . . . . 0.0 110.372 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.47 ' N ' ' CD2' ' A' ' 4' ' ' LEU . 3.8 mm? 52.85 10.78 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.585 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.464 ' H ' ' C ' ' A' ' 3' ' ' GLU . 74.7 t80 -68.19 -29.57 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.398 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.83 133.73 44.58 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.312 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.599 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 t -72.5 -38.18 5.02 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.13 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 41.0 Cg_exo -56.35 -22.35 41.08 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 121.565 1.51 . . . . 0.0 111.892 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.401 ' CD1' ' CD1' ' A' ' 4' ' ' LEU . 39.2 t80 -60.64 -48.15 83.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.828 0.347 . . . . 0.0 110.285 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.0 m-85 -57.75 -37.37 73.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.087 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -67.94 -44.11 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.006 0.431 . . . . 0.0 110.526 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -51.95 -26.41 10.39 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -72.16 -30.92 65.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.968 0.413 . . . . 0.0 110.21 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 50.3 mt -68.83 -38.89 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.701 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.32 -34.13 73.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.091 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -66.33 -29.36 69.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.595 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 47.6 m170 -71.43 -53.52 13.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.78 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.91 -39.45 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.755 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.28 -55.62 31.49 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.809 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.442 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 69.0 mtm -107.51 -62.77 1.38 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.952 0.406 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 8.2 t30 83.56 51.56 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.795 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -48.19 -41.93 28.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.513 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -160.83 65.87 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.593 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' C ' HD22 ' A' ' 21' ' ' ASN . 20.2 tp10 -158.72 -134.73 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.418 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 73.4 m-20 -148.14 -166.22 2.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.188 0.518 . . . . 0.0 110.363 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -86.09 -110.03 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.428 ' C ' ' H ' ' A' ' 29' ' ' ALA . 17.9 tt -61.29 -33.63 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 120.797 0.332 . . . . 0.0 110.351 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.715 ' NE2' HD21 ' A' ' 31' ' ' ASN . 46.4 t-80 -67.42 2.05 1.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -66.59 -45.48 79.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.562 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -63.15 -43.86 97.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.89 179.82 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.715 HD21 ' NE2' ' A' ' 28' ' ' HIS . 43.8 t30 -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.609 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -66.2 -53.57 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.86 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.422 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 64.1 t80 -61.0 -46.34 91.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.614 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 33.8 t80 -58.77 -42.36 88.77 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.487 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -67.4 -31.21 71.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 0.0 110.199 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.9 t -70.94 -42.69 69.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.1 t -67.32 -61.22 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.479 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.8 p -47.94 -40.88 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.074 -179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.6 m -54.0 -47.49 71.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 96.3 m -83.67 -32.49 25.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.664 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.2 tt -56.35 -45.01 80.61 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.149 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 77.8 t -68.48 -4.92 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.189 0.518 . . . . 0.0 110.529 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -113.94 -39.89 3.86 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.802 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -46.83 -47.86 21.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.337 0.589 . . . . 0.0 110.097 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -103.15 -91.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.276 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 73.2 35.04 0.96 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.986 0.422 . . . . 0.0 110.191 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 t -98.24 -23.84 15.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.735 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -167.04 131.65 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.753 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -52.24 -34.72 47.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.285 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.03 -48.64 57.13 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.944 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -50.82 -42.75 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.693 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -76.28 -31.98 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.612 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.35 -47.56 83.66 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.673 -178.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' CE1' ' A' ' 58' ' ' HIS . 2.1 ptpp? -63.36 -40.92 98.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.393 0.616 . . . . 0.0 110.157 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -65.29 -43.58 90.71 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.27 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.63 -44.47 99.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -55.09 -31.23 61.05 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.435 ' CE1' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -71.9 -36.5 70.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 18.6 tp -73.56 -29.09 62.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.471 ' O ' ' CD2' ' A' ' 63' ' ' TYR . 90.8 m-20 -52.53 -38.91 60.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.993 0.425 . . . . 0.0 110.322 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -66.84 -18.7 65.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.486 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.13 -61.69 1.8 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.019 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.605 ' CD1' ' NH2' ' B' ' 35' ' ' ARG . 1.0 OUTLIER -56.01 -40.41 73.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.884 0.85 . . . . 0.0 110.154 -179.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.468 ' N ' ' CG ' ' A' ' 63' ' ' TYR . 52.2 t30 -62.83 -40.27 96.9 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.468 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -58.16 -42.68 86.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.2 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.482 ' O ' ' N ' ' A' ' 70' ' ' GLU . 72.7 t -62.88 -55.65 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.207 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 21.0 mtmt -63.15 -43.05 99.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.513 0.673 . . . . 0.0 111.336 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -66.79 -18.89 65.6 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.11 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 70' ' ' GLU . . . -107.86 -13.11 20.93 Favored Glycine 0 N--CA 1.464 0.554 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 66' ' ' VAL . 4.2 mm-40 -47.89 178.19 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.183 0.516 . . . . 0.0 110.657 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.567 ' O ' ' N ' ' A' ' 73' ' ' LEU . 39.1 t -63.6 81.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.471 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mttp 60.93 -66.69 0.05 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.678 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.567 ' N ' ' O ' ' A' ' 71' ' ' SER . 4.8 tp 65.12 43.86 3.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.292 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -68.41 -59.65 3.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.313 0.578 . . . . 0.0 110.458 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.8 m170 53.99 100.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.445 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 61.8 m80 54.45 70.33 0.63 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.539 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -63.29 -42.18 99.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.519 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -164.3 75.84 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.546 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -69.77 131.62 44.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.335 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.662 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 12.3 m 53.01 14.0 0.42 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.583 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -68.99 136.08 51.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.119 0.485 . . . . 0.0 110.224 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 tt -78.55 107.9 11.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.471 0.653 . . . . 0.0 109.975 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -91.26 72.41 6.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.071 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p 46.61 -159.08 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 3.2 t -55.24 -54.97 44.62 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 118.903 -0.57 . . . . 0.0 109.808 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 52.3 Cg_exo -34.3 -27.5 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.009 0 C-N-CA 121.7 1.6 . . . . 0.0 113.124 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 7' ' ' VAL . 57.5 t80 -58.35 -37.77 75.84 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.304 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.44 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -61.78 -43.18 99.36 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.5 -46.95 82.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.84 0.828 . . . . 0.0 110.738 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -49.32 -23.14 1.29 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.63 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . 0.414 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 18.5 m120 -74.93 -36.09 62.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.517 0.675 . . . . 0.0 110.595 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.4 mt -69.13 -38.51 78.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.34 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -54.15 -39.98 67.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.165 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.446 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.0 tt0 -70.71 -31.81 68.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.238 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.469 ' O ' ' ND2' ' B' ' 21' ' ' ASN . 43.2 m170 -66.74 -50.41 62.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.704 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.3 pt -72.93 -36.16 50.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.329 0.585 . . . . 0.0 110.656 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -77.39 -54.65 6.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.069 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.446 ' N ' ' O ' ' B' ' 16' ' ' GLN . 18.8 tpp -81.77 -58.65 2.9 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.257 0.551 . . . . 0.0 110.54 -179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 17' ' ' HIS . 3.1 m120 69.5 36.76 2.13 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.866 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -60.28 -38.65 84.23 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.276 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.1 m -152.22 60.07 0.84 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.742 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -166.7 -133.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.139 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -158.44 -168.58 2.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.407 0.623 . . . . 0.0 110.358 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -85.8 -104.23 0.06 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.277 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.498 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.4 mm -61.31 -37.34 77.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -64.42 3.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.882 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.498 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.78 -46.81 51.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.828 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.41 ' HG3' ' H ' ' B' ' 31' ' ' ASN . 1.0 OUTLIER -62.5 -50.84 69.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.948 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.41 ' H ' ' HG3' ' B' ' 30' ' ' MET . 89.5 m-20 -58.75 -48.04 82.57 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.447 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -65.34 -53.79 38.54 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.546 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.44 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 39.5 t80 -60.11 -53.14 61.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.078 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.407 ' CB ' ' O ' ' B' ' 30' ' ' MET . 55.1 t80 -53.44 -42.06 66.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.605 ' NH2' ' CD1' ' A' ' 63' ' ' TYR . 73.0 ttt-85 -68.55 -35.17 77.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.2 t -64.6 -43.0 95.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.486 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . 0.566 ' O ' ' N ' ' B' ' 41' ' ' LEU . 62.2 t -67.1 -65.35 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.421 ' CG2' ' N ' ' B' ' 39' ' ' SER . 29.9 m -47.64 -49.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.7 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.421 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 34.2 p -47.48 -61.09 2.09 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 119.994 -0.682 . . . . 0.0 111.401 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.418 ' H ' ' HG ' ' B' ' 39' ' ' SER . 97.6 m -74.62 -44.18 51.84 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.273 1.035 . . . . 0.0 111.03 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.566 ' N ' ' O ' ' B' ' 37' ' ' VAL . 51.3 tp -57.31 -34.44 68.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.579 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.417 ' CG2' ' O ' ' B' ' 38' ' ' VAL . 53.6 t -75.65 -2.28 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.9 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -155.58 41.04 0.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.401 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -99.12 -59.45 1.72 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.101 0.477 . . . . 0.0 110.389 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -113.19 -31.97 6.45 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.528 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 tt 48.79 68.02 0.77 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.257 0.551 . . . . 0.0 110.163 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.2 t -96.49 -25.34 15.69 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.298 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -180.0 140.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.688 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -61.97 -44.77 96.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.76 86.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 9.0 t -57.93 -62.04 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.704 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 25.5 m -54.03 -33.82 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.434 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -61.72 2.21 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.048 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.32 -34.67 64.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.206 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -65.34 -39.57 92.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 86.5 mt -67.65 -49.97 65.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.335 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -56.52 -38.28 71.63 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.479 ' CE1' ' OE1' ' B' ' 61' ' ' GLU . 34.0 t60 -69.78 -43.29 72.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.32 -27.5 47.49 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.488 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -53.29 -36.71 61.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.435 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.479 ' OE1' ' CE1' ' B' ' 58' ' ' HIS . 5.8 pt-20 -57.72 -31.27 66.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.387 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.43 -58.13 4.05 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.79 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.3 -40.71 49.37 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.032 0.444 . . . . 0.0 109.933 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -68.98 -36.62 78.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.578 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -65.05 -35.77 82.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.616 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 77.6 t -57.24 -52.92 50.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.09 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -69.69 -38.4 76.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.012 0.911 . . . . 0.0 111.664 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -40.85 -32.84 0.25 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.394 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.93 -44.76 5.91 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.3 152.4 43.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.056 0.455 . . . . 0.0 110.035 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.581 ' C ' ' H ' ' B' ' 73' ' ' LEU . 22.9 t -166.59 36.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.288 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt 60.67 -42.47 0.11 Allowed 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.651 0.738 . . . . 0.0 111.511 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' B' ' 71' ' ' SER . 86.8 mt -67.92 -34.03 75.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.362 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' B' ' 76' ' ' HIS . 76.2 mm-40 53.17 64.5 1.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.313 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -62.61 81.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.389 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.435 ' O ' ' N ' ' B' ' 78' ' ' HIS . 69.4 m80 -63.96 -44.58 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.32 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 43.1 m170 48.14 -92.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.552 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' B' ' 76' ' ' HIS . 83.0 t60 48.42 71.82 0.33 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.626 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 52.83 79.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.658 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' B' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.627 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mmm . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 t 53.22 -152.57 0.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.739 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -159.27 90.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.624 0.726 . . . . 0.0 110.68 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -87.02 6.17 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -56.47 -43.74 79.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.197 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -64.29 131.43 47.3 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.023 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.585 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.9 t -65.84 -40.47 39.32 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.124 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 49.9 Cg_exo -54.19 -26.61 43.19 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 121.79 1.66 . . . . 0.0 112.066 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.19 -41.05 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.281 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.456 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.6 m-85 -60.38 -39.39 87.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.364 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.412 ' O ' ' N ' ' A' ' 14' ' ' LEU . 55.3 mt -67.79 -45.27 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.979 0.419 . . . . 0.0 110.461 -179.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -48.2 -23.99 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.529 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -74.48 -33.79 62.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 110.685 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.412 ' N ' ' O ' ' A' ' 11' ' ' ILE . 21.9 mt -72.58 -37.51 68.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.314 -179.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -57.26 -41.08 79.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.993 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.504 HE21 HE21 ' A' ' 22' ' ' GLN . 56.4 tt0 -67.95 -31.29 70.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.543 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -66.17 -50.69 63.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.819 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 pt -70.92 -39.94 75.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.25 0.548 . . . . 0.0 110.83 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -57.59 -53.86 53.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.252 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 72.8 mtm -114.49 -118.82 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.404 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -171.67 61.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.377 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.504 HE21 HE21 ' A' ' 16' ' ' GLN . 8.1 tp-100 -73.41 50.35 0.31 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 122.105 0.955 . . . . 0.0 110.96 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 76.79 55.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.136 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -156.51 -134.68 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.21 0.528 . . . . 0.0 110.614 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -159.38 -169.29 2.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.21 -179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.7 tttm -80.71 -105.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.356 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.488 ' C ' ' H ' ' A' ' 29' ' ' ALA . 6.9 tt -65.71 -31.12 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.53 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -69.86 10.33 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.557 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.56 -45.18 22.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.358 0.599 . . . . 0.0 110.872 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.55 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.9 ptm -62.01 -50.76 70.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.401 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.421 ' H ' ' HG3' ' A' ' 30' ' ' MET . 47.7 t30 -53.61 -46.91 70.59 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.397 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -67.05 -53.6 29.59 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.055 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.456 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 47.4 t80 -62.4 -49.63 74.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.385 0.612 . . . . 0.0 110.99 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.55 ' N ' ' O ' ' A' ' 30' ' ' MET . 75.9 t80 -54.56 -47.94 72.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.07 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -65.25 -38.1 89.29 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 33' ' ' TYR . 33.4 p -59.89 -43.41 94.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.401 -179.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 98.0 t -70.89 -49.55 49.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.468 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.6 -49.25 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.396 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.8 t -59.02 -35.92 74.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.817 0.341 . . . . 0.0 110.452 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 90.1 m -71.66 -49.77 36.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.412 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -49.74 -34.26 18.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -86.21 -33.48 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.5 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 44' ' ' ASP . 84.3 mt-30 -111.33 81.63 1.47 Allowed 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.989 0.9 . . . . 0.0 109.736 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.458 ' CB ' ' O ' ' A' ' 43' ' ' GLN . 3.6 t70 156.94 136.44 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.204 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.408 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 56.4 tt0 69.21 -62.23 0.41 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt 45.56 70.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.058 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -101.25 -28.9 12.39 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.302 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.416 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 34.5 ttpt -178.17 144.83 0.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.232 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.91 -41.96 97.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.416 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -58.37 -46.18 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.982 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.4 -64.86 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.74 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 31.9 m -53.8 -39.69 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.602 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 57.4 tp -60.43 -52.27 65.94 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.733 -179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 49.5 mtpt -52.07 -37.02 52.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.568 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -66.48 -34.28 77.59 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.181 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.7 mt -71.81 -52.77 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.779 -0.369 . . . . 0.0 110.354 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.76 -32.98 69.77 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.141 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.4 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -77.12 -46.91 21.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.6 tp -52.23 -27.16 13.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.44 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -51.26 -38.35 52.21 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.397 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -54.71 -33.02 60.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.588 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.49 16.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.549 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.461 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.29 -44.81 68.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.141 0.496 . . . . 0.0 110.318 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -65.83 -35.56 81.02 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.961 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.32 -40.01 94.93 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.416 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.65 -48.81 86.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.455 0.645 . . . . 0.0 110.467 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -44.14 92.38 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.414 1.102 . . . . 0.0 111.698 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -55.77 -27.67 52.15 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.63 -8.5 84.58 Favored Glycine 0 CA--C 1.518 0.262 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 61.6 mm-40 -122.44 -135.88 0.3 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 72' ' ' LYS . 5.5 p 69.42 -63.12 0.39 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 122.371 1.081 . . . . 0.0 110.674 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.509 ' N ' ' OG ' ' A' ' 71' ' ' SER . 71.8 mmtt 72.4 113.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.24 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 46.9 mt 60.95 -136.86 0.6 Allowed 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.767 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 53.86 73.7 0.37 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.118 0.485 . . . . 0.0 110.474 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.404 ' ND1' ' H ' ' A' ' 75' ' ' HIS . 39.2 p-80 -102.07 23.65 11.25 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.391 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.474 ' CD2' ' O ' ' A' ' 78' ' ' HIS . 4.1 t60 -138.93 134.34 33.05 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.162 0.506 . . . . 0.0 110.749 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -62.92 -88.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.681 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.474 ' O ' ' CD2' ' A' ' 76' ' ' HIS . 54.5 t-80 -72.93 150.25 42.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.523 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.414 ' CG ' ' N ' ' A' ' 80' ' ' HIS . 84.6 t60 -71.0 160.26 33.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.487 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' N ' ' CG ' ' A' ' 79' ' ' HIS . 59.3 t-80 . . . . . 0 C--O 1.219 -0.53 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.627 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 78.4 p -67.33 -16.96 64.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.37 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -53.84 153.54 4.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.626 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.442 ' CD1' ' CD1' ' B' ' 9' ' ' TYR . 4.3 mm? -46.4 114.37 0.8 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.751 0.786 . . . . 0.0 110.417 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -73.64 64.47 0.9 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.747 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 43.7 t 55.6 -163.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.739 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.473 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.7 t -57.4 -54.92 49.8 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.148 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 50.2 Cg_exo -35.06 -29.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.117 1.878 . . . . 0.0 113.081 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . 0.472 ' N ' ' O ' ' B' ' 7' ' ' VAL . 41.0 t80 -56.22 -41.85 76.3 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.018 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.8 m-85 -62.11 -40.23 95.18 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 36.3 mt -64.86 -48.78 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 121.295 0.569 . . . . 0.0 110.343 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.85 -26.49 35.71 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.311 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . 0.451 ' ND2' ' O ' ' B' ' 9' ' ' TYR . 4.5 m120 -69.49 -35.57 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.872 0.368 . . . . 0.0 110.235 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.3 -36.92 80.08 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.635 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -56.42 -32.54 64.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.033 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' B' ' 20' ' ' MET . 1.9 pt20 -67.25 -35.06 78.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.378 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -65.33 -50.74 64.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.505 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.8 pt -73.36 -41.73 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.564 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -72.07 -53.77 11.86 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.428 ' N ' ' O ' ' B' ' 16' ' ' GLN . 24.8 ttm -86.47 -69.06 0.7 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.106 0.479 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' B' ' 25' ' ' ASP . 43.2 t30 74.93 45.03 0.16 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.706 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -40.04 -34.35 0.28 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.461 0.648 . . . . 0.0 111.097 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.1 p -167.09 -20.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.659 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -61.42 -132.52 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.917 0.389 . . . . 0.0 110.593 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 69.1 m-20 -155.79 -166.29 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.351 0.596 . . . . 0.0 110.099 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.41 -101.81 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.793 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.581 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.7 mm -65.66 -39.69 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.186 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . 0.629 ' ND1' HD21 ' B' ' 31' ' ' ASN . 73.2 t60 -65.64 11.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.278 . . . . 0.0 110.508 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.581 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.92 -49.25 18.35 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.938 0.399 . . . . 0.0 110.475 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.594 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -58.01 -39.93 79.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.258 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.629 HD21 ' ND1' ' B' ' 28' ' ' HIS . 93.2 m-20 -49.75 -40.4 40.91 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.415 ' O ' ' OG ' ' B' ' 36' ' ' SER . 22.3 t -80.12 -55.92 4.59 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.619 178.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 63.4 t80 -58.18 -46.6 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.085 0.469 . . . . 0.0 110.887 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.594 ' N ' ' O ' ' B' ' 30' ' ' MET . 28.9 t80 -57.22 -51.52 68.99 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.897 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 74.9 ttt180 -67.08 -25.94 66.48 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' B' ' 32' ' ' SER . 48.7 m -70.9 -46.95 61.64 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.566 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' B' ' 40' ' ' THR . 77.8 t -64.95 -65.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.63 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.43 ' CG2' ' N ' ' B' ' 39' ' ' SER . 23.6 m -45.69 -46.23 4.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.537 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.43 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 42.0 t -59.67 -26.58 65.66 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.458 ' O ' ' N ' ' B' ' 44' ' ' ASP . 28.9 m -85.22 -51.12 6.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.779 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.88 -45.05 91.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.78 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.7 t -58.23 -22.1 18.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.078 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -103.8 -26.79 12.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.577 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' B' ' 40' ' ' THR . 51.3 t0 -56.74 -47.4 80.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.207 0.527 . . . . 0.0 110.766 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -133.38 -167.09 1.87 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.313 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 179.1 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.578 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.91 -45.49 92.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.264 0.554 . . . . 0.0 110.284 -179.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -156.89 133.0 9.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -50.24 -25.3 3.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.617 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.478 ' C ' ' HZ1' ' B' ' 54' ' ' LYS . . . -78.16 -53.4 7.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.075 0.464 . . . . 0.0 110.948 179.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 23.3 t -46.04 -39.52 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.286 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -77.05 -32.01 19.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.25 0.547 . . . . 0.0 110.599 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 tp -59.95 -29.83 68.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.259 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.478 ' HZ1' ' C ' ' B' ' 50' ' ' ALA . 28.5 mmtm -62.03 -46.7 88.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.453 0.644 . . . . 0.0 110.525 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -64.95 -42.74 94.36 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.399 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 78.4 mt -62.8 -50.1 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.451 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -54.33 -35.76 63.04 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 8.9 m-70 -72.36 -22.3 61.17 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.42 -23.97 53.98 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.347 179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.4 -41.67 98.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.452 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 58' ' ' HIS . 7.9 pt-20 -61.77 -31.47 71.67 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.947 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.93 -57.86 4.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.532 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -42.97 55.9 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 110.212 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -63.43 -33.72 76.17 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.765 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -64.4 -38.1 89.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.441 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.01 -48.33 89.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.464 0.65 . . . . 0.0 110.4 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -48.21 50.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.211 1.005 . . . . 0.0 111.692 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -59.46 -35.17 73.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.106 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.44 -16.56 75.68 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -97.1 -171.32 2.19 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.047 0.451 . . . . 0.0 110.583 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 37.3 t -166.01 166.67 17.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.252 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -74.44 -55.49 5.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.534 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' B' ' 75' ' ' HIS . 2.2 pp -155.39 -26.79 0.11 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.016 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -50.44 89.21 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.918 0.866 . . . . 0.0 109.984 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' B' ' 73' ' ' LEU . 47.2 t-80 60.23 72.49 0.52 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.297 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -157.45 76.59 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.632 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -146.06 156.95 43.82 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.449 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -69.65 128.84 37.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.385 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -77.4 140.15 39.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.409 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.1 -0.952 . . . . 0.0 110.763 -179.975 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 t 69.03 -56.32 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.522 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 52.9 91.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.43 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -170.67 -21.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.552 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -62.48 -45.65 92.04 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.227 0.537 . . . . 0.0 110.218 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -76.03 131.76 39.71 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.234 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.616 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 57.2 t -65.04 -48.25 71.36 Favored Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 9.0 Cg_endo -47.34 -23.64 3.35 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 121.636 1.557 . . . . 0.0 112.296 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -62.32 -43.69 98.24 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.04 0.448 . . . . 0.0 110.491 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.464 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -61.4 -41.93 97.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.103 -179.835 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.4 mt -60.27 -44.2 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.288 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -52.12 -23.95 6.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.753 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -66.58 -38.4 86.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.51 -36.94 65.82 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.812 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptt -52.95 -32.99 48.97 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.143 0.497 . . . . 0.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.5 tt0 -68.95 -33.67 74.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.603 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -63.57 -51.86 63.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.616 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.401 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 9.0 pt -73.96 -45.48 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.291 0.567 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.1 tt0 -67.61 -38.87 84.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.263 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.422 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 5.7 ttm -111.04 -164.07 0.89 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.596 0.713 . . . . 0.0 110.253 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -154.83 45.36 0.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.36 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -56.55 -46.01 80.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.129 0.49 . . . . 0.0 110.408 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.4 ' O ' ' OG ' ' A' ' 23' ' ' SER . 4.0 t 176.81 67.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.397 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -161.35 -133.72 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 110.358 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -156.69 -168.67 2.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.185 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 60.9 tttp -80.34 -104.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.557 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.7 tt -64.86 -35.46 75.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.65 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -67.44 12.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.623 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.557 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -77.93 -45.73 23.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.118 0.485 . . . . 0.0 110.585 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -61.06 -43.94 98.12 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.526 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' A' ' 30' ' ' MET . 26.4 t-20 -50.25 -40.33 47.52 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.493 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -78.59 -55.42 5.21 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.755 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.464 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 78.8 t80 -59.49 -48.92 79.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.188 0.518 . . . . 0.0 110.681 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.531 ' N ' ' O ' ' A' ' 30' ' ' MET . 64.7 t80 -54.56 -44.39 72.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.859 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -71.28 -28.02 63.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.9 m -70.03 -48.02 59.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.037 0.446 . . . . 0.0 110.711 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -71.26 -45.26 71.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.466 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.26 -42.48 66.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.29 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.5 p -64.5 -25.9 68.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.78 0.324 . . . . 0.0 110.498 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 94.4 m -84.21 -45.69 12.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.718 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.92 -43.06 91.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.867 -179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 p -70.79 -27.37 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 121.463 0.649 . . . . 0.0 110.931 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.529 ' O ' ' C ' ' A' ' 44' ' ' ASP . 66.4 mt-30 -86.04 -28.44 24.14 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.629 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.529 ' C ' ' O ' ' A' ' 43' ' ' GLN . 77.0 m-20 -24.96 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 47' ' ' THR . 10.4 pt20 -156.55 7.68 0.2 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.051 0.453 . . . . 0.0 110.627 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.477 ' C ' ' O ' ' A' ' 45' ' ' GLN . 1.0 OUTLIER 27.93 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.486 0.66 . . . . 0.0 111.075 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 45' ' ' GLN . 9.8 t -60.53 -29.92 69.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.588 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -157.99 126.31 5.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.58 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.401 ' CG ' ' ND2' ' B' ' 49' ' ' ASN . 17.1 p30 -46.74 -35.82 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.198 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.68 70.37 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.888 0.375 . . . . 0.0 110.697 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.56 -45.07 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.642 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.35 -41.16 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.114 0.483 . . . . 0.0 110.925 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.68 -48.52 74.44 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.052 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.42 -43.58 93.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.802 0.81 . . . . 0.0 110.411 -178.936 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.466 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 19.5 tpt85 -63.35 -37.03 85.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.129 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.25 -45.18 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.419 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.99 -36.62 72.89 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.381 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.6 m170 -72.63 -43.5 63.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.34 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -53.56 -30.43 41.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.748 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -51.77 -29.2 17.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -60.96 -32.51 72.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.3 -56.56 5.78 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.729 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -44.99 66.36 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.976 0.417 . . . . 0.0 110.121 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.74 -35.53 80.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.0 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -57.34 -42.78 82.61 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.457 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.8 -49.68 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 121.536 0.684 . . . . 0.0 110.484 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.97 -43.38 92.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.82 0.819 . . . . 0.0 111.523 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.05 -23.3 63.63 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.109 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.41 -17.85 20.73 Favored Glycine 0 N--CA 1.465 0.597 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 5.8 mm-40 -107.61 169.29 8.68 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.354 0.597 . . . . 0.0 110.323 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p 45.52 92.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -67.9 -95.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.483 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.423 ' N ' ' CD1' ' A' ' 73' ' ' LEU . 9.5 mp -74.09 147.87 42.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 0.0 109.916 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.05 54.76 1.79 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.212 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -66.81 -65.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.292 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.488 ' CG ' ' N ' ' A' ' 77' ' ' HIS . 76.3 t60 51.51 -109.38 0.43 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.516 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' ' CG ' ' A' ' 76' ' ' HIS . 63.9 t-80 -72.42 128.11 34.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.035 0.445 . . . . 0.0 110.38 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -90.44 119.43 30.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.299 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.457 ' O ' ' CG ' ' A' ' 80' ' ' HIS . 99.0 m-70 -60.91 -69.55 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.591 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 79' ' ' HIS . 74.0 m80 . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.448 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.519 ' SD ' ' N ' ' B' ' 1' ' ' MET . 4.4 mpp? . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 35.2 t -167.56 9.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.371 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' B' ' 3' ' ' GLU . 1.3 pm0 -158.63 77.4 0.76 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.613 0.721 . . . . 0.0 110.845 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.97 27.27 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.148 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -59.61 -47.3 86.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 120.959 0.409 . . . . 0.0 109.931 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.47 131.15 38.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.161 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.594 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -55.77 -50.53 86.6 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.807 178.65 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.594 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 5.7 Cg_endo -44.62 -17.49 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.987 1.792 . . . . 0.0 112.217 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . 0.437 ' N ' ' O ' ' B' ' 7' ' ' VAL . 81.0 t80 -69.28 -43.01 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.154 0.502 . . . . 0.0 110.433 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -68.21 -46.09 71.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.659 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' B' ' 14' ' ' LEU . 40.6 mt -62.8 -43.61 98.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.086 0.47 . . . . 0.0 110.29 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -46.34 -21.96 0.21 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.205 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . 0.416 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 46.4 m-20 -73.03 -39.29 66.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.905 0.383 . . . . 0.0 110.363 179.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.473 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 7.3 mp -71.13 -37.01 72.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.64 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -55.98 -42.31 76.1 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.323 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -66.92 -31.63 72.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.416 ' CD2' ' O ' ' B' ' 13' ' ' ASN . 45.1 m170 -66.98 -51.73 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.156 0.503 . . . . 0.0 110.672 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.1 pt -74.11 -43.69 51.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.833 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.7 -53.61 21.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 8.5 tpp -88.15 -157.87 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.5 0.666 . . . . 0.0 109.992 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -157.74 46.28 0.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.321 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -63.03 -51.98 64.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.252 0.549 . . . . 0.0 110.497 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.7 p -174.91 72.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -166.52 -136.2 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.991 0.424 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -157.44 -158.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 64.1 tttm -94.91 -103.01 0.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.431 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.438 ' C ' ' H ' ' B' ' 29' ' ' ALA . 1.6 mm -61.59 -36.71 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.114 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.64 4.86 2.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.613 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.438 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -73.98 -50.24 20.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.723 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.543 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -61.46 -43.52 98.73 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.253 179.486 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.543 ' N ' ' SD ' ' B' ' 30' ' ' MET . 15.0 m120 -53.71 -48.46 69.55 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.587 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -66.91 -53.22 34.16 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.818 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 57.0 t80 -61.79 -50.06 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.26 0.553 . . . . 0.0 110.849 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.502 ' N ' ' O ' ' B' ' 30' ' ' MET . 75.1 t80 -54.71 -45.52 74.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.722 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -68.62 -37.0 79.4 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.617 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 55.2 m -61.96 -44.18 97.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.217 0.532 . . . . 0.0 110.772 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.7 t -72.05 -46.27 59.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.597 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 38.0 t -50.47 -44.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.351 -179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 10.7 t -63.39 -34.64 78.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.191 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -72.61 -49.92 28.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.143 0.497 . . . . 0.0 110.936 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.441 ' CD2' ' NH2' ' B' ' 55' ' ' ARG . 97.3 mt -50.91 -34.93 30.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.948 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.5 t -87.77 -32.81 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.441 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -119.72 82.58 1.91 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.527 0.68 . . . . 0.0 110.176 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -167.64 -71.22 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.998 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . 0.63 ' NE2' HH12 ' B' ' 55' ' ' ARG . 5.2 pt20 -105.54 -38.35 6.48 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.342 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 tp 37.85 54.19 1.56 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.787 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.5 t -83.89 -24.79 30.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 35.6 tptt -173.78 138.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.751 -179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.536 ' ND2' ' N ' ' B' ' 50' ' ' ALA . 2.1 p-10 -54.59 -46.15 73.71 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.808 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.536 ' N ' ' ND2' ' B' ' 49' ' ' ASN . . . -58.66 -45.7 88.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.432 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.67 -34.34 47.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.005 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 39.3 t -81.89 -45.07 20.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.591 0.71 . . . . 0.0 111.1 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -52.35 65.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.907 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.437 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.2 pttp -53.36 -40.58 65.06 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.63 HH12 ' NE2' ' B' ' 45' ' ' GLN . 77.3 mtp180 -68.34 -37.28 80.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.118 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 4.3 mm -64.38 -50.65 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.459 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -61.39 -37.22 82.61 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.255 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.496 ' CE1' ' OE2' ' B' ' 61' ' ' GLU . 5.7 t-80 -67.55 -46.98 71.16 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.888 0.375 . . . . 0.0 110.233 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.7 tp -49.88 -30.43 10.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.685 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -52.21 -30.83 29.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.7 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.496 ' OE2' ' CE1' ' B' ' 58' ' ' HIS . 9.5 pt-20 -58.1 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.602 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.43 -53.47 28.83 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.836 0.35 . . . . 0.0 110.475 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -46.28 72.04 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 110.193 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.476 ' ND2' ' CZ ' ' B' ' 68' ' ' ARG . 49.9 t30 -63.75 -36.67 84.65 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.315 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 30.5 tptt -60.26 -33.6 72.53 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.61 -43.15 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 122.028 0.918 . . . . 0.0 110.515 -178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.476 ' CB ' ' HZ1' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -69.0 -44.77 72.13 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.655 -179.116 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . 0.476 ' CZ ' ' ND2' ' B' ' 64' ' ' ASN . 87.2 mtm180 -66.82 -21.93 66.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.336 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.443 ' O ' ' N ' ' B' ' 72' ' ' LYS . . . -89.69 -70.1 1.24 Allowed Glycine 0 N--CA 1.463 0.453 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' B' ' 26' ' ' LYS . 2.7 pp20? -37.82 -38.82 0.31 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.686 0.755 . . . . 0.0 111.464 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.403 ' N ' ' CD ' ' B' ' 70' ' ' GLU . 74.2 m -50.53 -38.98 47.69 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.013 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.443 ' N ' ' O ' ' B' ' 69' ' ' GLY . 68.8 mttm -134.47 -163.04 1.31 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.069 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.4 tp 48.89 70.2 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.641 -179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.409 ' C ' ' H ' ' B' ' 76' ' ' HIS . 69.3 mm-40 -111.9 -2.67 15.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.54 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 55.7 t-80 54.23 12.28 0.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.901 0.382 . . . . 0.0 110.438 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.622 ' H ' ' HD1' ' B' ' 76' ' ' HIS . 0.3 OUTLIER -72.95 134.33 44.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.395 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 47.99 92.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.74 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.423 ' CD2' ' H ' ' B' ' 80' ' ' HIS . 79.6 t60 -160.26 141.75 12.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.47 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -59.45 -44.77 92.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.52 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . 0.423 ' H ' ' CD2' ' B' ' 78' ' ' HIS . 85.0 t60 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.696 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -139.76 149.38 43.5 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.443 ' OE1' ' N ' ' A' ' 3' ' ' GLU . 40.1 mp0 -90.14 111.09 22.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.638 0.732 . . . . 0.0 110.325 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.77 12.57 33.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.248 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.19 -45.29 87.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.936 0.398 . . . . 0.0 110.159 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.7 137.88 44.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.18 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.577 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -67.66 -41.8 32.16 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.868 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 52.4 Cg_exo -52.85 -24.82 25.25 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.02 1.814 . . . . 0.0 111.92 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -61.62 -47.2 86.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.842 0.353 . . . . 0.0 110.331 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.503 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 2.9 m-85 -59.41 -40.47 86.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.293 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.9 mt -64.71 -43.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-O 121.032 0.444 . . . . 0.0 110.295 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -52.02 -25.76 9.23 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.735 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -73.21 -35.46 66.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.269 0.557 . . . . 0.0 110.621 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.0 mt -70.55 -37.37 74.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.323 -179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -52.28 -39.67 60.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.069 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.01 -31.86 73.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.586 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.32 -51.95 46.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.697 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.95 -44.32 57.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 80.4 tt0 -53.94 -55.34 27.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.45 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 58.2 mtm -113.11 -133.34 0.34 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.921 0.391 . . . . 0.0 110.202 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p30 -171.48 52.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.332 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -45.08 74.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.491 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -174.56 62.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -166.17 -133.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.399 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -157.39 -162.95 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 110.325 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 64.2 tttm -83.44 -104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.356 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.576 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.8 mt -66.11 -37.42 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -63.69 6.47 0.15 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.612 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.576 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.16 -45.8 22.28 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.466 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.61 -44.85 95.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.479 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.573 ' N ' ' SD ' ' A' ' 30' ' ' MET . 39.2 t30 -51.63 -50.69 59.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.557 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.0 m -65.51 -53.38 43.15 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.633 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.503 ' OH ' ' CD1' ' A' ' 10' ' ' PHE . 4.9 t80 -61.46 -23.46 65.89 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.368 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 30' ' ' MET . 82.8 t80 -76.74 -57.61 3.76 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.376 0.608 . . . . 0.0 110.953 -178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 39' ' ' SER . 0.2 OUTLIER -65.72 -23.81 66.84 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.979 179.71 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.63 ' HG ' ' H ' ' A' ' 37' ' ' VAL . 93.0 p -71.2 -49.88 38.91 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.541 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.63 ' H ' ' HG ' ' A' ' 36' ' ' SER . 79.8 t -70.8 -56.35 11.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.934 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.2 t -49.97 -48.04 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.501 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 35' ' ' ARG . 58.2 m -54.96 -52.29 63.5 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.798 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.0 m -68.92 -44.17 73.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.754 0.788 . . . . 0.0 110.981 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.72 -40.69 88.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.432 -178.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 26.5 t -96.0 26.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.106 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -165.9 27.77 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -154.54 17.48 0.46 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.705 0.288 . . . . 0.0 110.541 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -153.38 -77.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.359 -179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.8 tp 59.41 41.41 19.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 110.642 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 33.8 m -70.85 -40.49 72.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.51 0.671 . . . . 0.0 110.966 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -175.53 143.15 0.61 Allowed 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.627 -179.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.421 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 65.7 m-20 -50.08 -45.93 52.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.724 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.07 -46.91 82.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.706 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.457 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . 49.9 t -57.02 -47.23 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.863 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.417 ' CG2' ' N ' ' A' ' 53' ' ' LEU . 15.9 m -76.55 -46.65 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.66 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.421 ' CB ' ' O ' ' A' ' 49' ' ' ASN . 60.0 tp -51.3 -58.6 5.76 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.884 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.472 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 17.5 pttm -50.5 -35.63 30.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.851 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 tpt85 -66.34 -44.7 82.54 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.199 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 50.6 mm -63.57 -52.51 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.487 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -56.61 -39.4 73.54 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.472 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -68.99 -44.0 73.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.273 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 tp -60.2 -33.68 72.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.87 0.367 . . . . 0.0 110.434 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -51.4 -39.55 57.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.541 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.75 -29.16 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.11 -54.0 21.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.773 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.7 -43.06 72.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.158 0.504 . . . . 0.0 110.118 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -66.07 -37.37 85.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.621 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.5 mmpt? -62.0 -34.58 76.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.239 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.58 -46.04 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.363 0.602 . . . . 0.0 110.153 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -67.96 -42.84 80.27 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.497 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -80.67 -10.41 59.73 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.151 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -97.66 -26.12 10.15 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.472 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 1.5 pp20? -88.17 -31.69 19.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.893 0.377 . . . . 0.0 110.329 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.479 ' OG ' ' N ' ' A' ' 72' ' ' LYS . 40.4 t -106.87 -167.79 1.33 Allowed 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.246 0.546 . . . . 0.0 110.579 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.479 ' N ' ' OG ' ' A' ' 71' ' ' SER . 1.3 ptpp? -159.68 69.17 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.462 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.8 tp 55.71 64.7 1.66 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.553 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -148.91 98.37 2.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.368 0.604 . . . . 0.0 110.127 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.446 ' O ' ' O ' ' A' ' 76' ' ' HIS . 25.6 p80 -168.34 134.46 1.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.468 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.529 ' CD2' ' H ' ' A' ' 78' ' ' HIS . 23.4 t-160 56.15 116.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.769 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -56.18 -42.32 76.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.429 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.529 ' H ' ' CD2' ' A' ' 76' ' ' HIS . 22.1 t-160 53.37 103.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.542 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -64.75 135.43 55.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.504 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.605 -179.912 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 84.1 mtp . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 26.0 t 52.25 98.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.628 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -154.01 159.8 41.76 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.559 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 1.9 tt -70.86 103.12 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.407 0.622 . . . . 0.0 110.158 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -102.25 78.6 1.77 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.107 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 46.6 t 53.35 -164.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.845 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.9 t -56.01 -55.59 39.84 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 46.6 Cg_exo -34.82 -26.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.052 1.835 . . . . 0.0 113.126 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 7' ' ' VAL . 89.8 t80 -56.65 -40.07 74.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.356 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.463 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -59.23 -45.39 91.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.072 -179.789 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.57 -43.99 83.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.319 0.581 . . . . 0.0 110.384 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -50.59 -25.86 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.507 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -76.08 -34.54 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.246 0.546 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.8 mt -73.25 -40.03 64.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.537 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.42 -37.11 74.69 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.997 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.447 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.4 tt0 -66.59 -41.43 88.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -59.08 -49.55 77.45 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.858 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.8 pt -73.31 -40.67 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.618 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -72.06 -60.42 2.24 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.144 -0.623 . . . . 0.0 110.964 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.53 ' SD ' ' N ' ' B' ' 20' ' ' MET . 0.0 OUTLIER -81.43 -66.29 0.91 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.719 HD22 ' N ' ' B' ' 25' ' ' ASP . 7.2 t-20 75.46 46.84 0.11 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -54.32 -41.35 68.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.008 0.432 . . . . 0.0 110.583 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 38.2 t -161.63 66.09 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.601 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . 0.443 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 29.2 tp10 -158.03 -127.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.394 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . 0.719 ' N ' HD22 ' B' ' 21' ' ' ASN . 62.3 m-20 -160.68 -172.41 3.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.239 0.543 . . . . 0.0 110.109 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -83.38 -103.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.288 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.04 -34.11 64.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.738 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -64.57 -5.56 5.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.28 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.6 -49.95 71.35 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.969 0.414 . . . . 0.0 110.682 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.533 ' O ' ' N ' ' B' ' 34' ' ' TYR . 12.2 tmm? -56.45 -48.35 77.25 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.797 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -52.83 -39.47 62.5 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.388 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.443 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 7.9 t -73.36 -54.5 8.17 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.116 -0.633 . . . . 0.0 110.773 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.463 ' OH ' ' CE2' ' B' ' 10' ' ' PHE . 38.0 t80 -63.08 -25.07 68.2 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.082 0.467 . . . . 0.0 110.973 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 30' ' ' MET . 29.7 t80 -72.82 -51.27 19.55 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.367 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.515 HH22 ' CG ' ' A' ' 31' ' ' ASN . 19.7 ptp180 -72.48 -20.52 61.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.54 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.8 t -70.8 -54.25 12.34 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.71 -178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 30.2 m -69.04 -43.39 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.35 179.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 48.3 t -49.97 -51.64 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.412 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 88.5 p -56.76 -45.91 81.75 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.493 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 93.6 m -68.31 -48.37 65.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.073 0.463 . . . . 0.0 110.873 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 78.0 mt -58.12 -45.78 86.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.515 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 73.2 t -69.41 -40.15 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -70.56 -29.33 65.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.901 ' O ' ' O ' ' B' ' 45' ' ' GLN . 38.5 m-20 -103.69 -150.39 0.42 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.831 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . 0.901 ' O ' ' O ' ' B' ' 44' ' ' ASP . 46.2 tt0 34.13 130.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.942 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.51 87.74 1.18 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.625 0.726 . . . . 0.0 109.727 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -141.26 -27.45 0.69 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.344 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -179.21 141.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 111.091 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 15.9 p30 -59.9 -38.5 82.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.468 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -64.32 -39.97 94.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.426 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 38.0 t -61.42 -62.7 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.537 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.52 -31.99 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.34 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 51.4 tp -69.73 -42.2 74.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.34 0.591 . . . . 0.0 110.895 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.474 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 24.1 pttt -53.48 -37.29 62.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.217 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.581 ' HE ' HE22 ' B' ' 45' ' ' GLN . 92.3 mtt-85 -65.15 -30.46 71.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.348 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 20.8 mm -74.52 -46.78 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.33 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -64.47 -24.57 67.66 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.08 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 1.6 m-70 -65.63 -50.47 64.89 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.58 -20.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' B' ' 58' ' ' HIS . 81.6 m-20 -52.29 -45.45 65.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.381 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.401 ' CG ' ' N ' ' B' ' 62' ' ' ALA . 8.2 pt-20 -62.82 -41.13 99.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.529 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . 0.401 ' N ' ' CG ' ' B' ' 61' ' ' GLU . . . -71.96 -47.14 54.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.891 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -42.69 58.15 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.102 0.477 . . . . 0.0 109.84 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.78 -36.31 80.24 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.551 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -62.58 -40.86 98.22 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.35 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.9 t -59.75 -50.49 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.253 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -51.19 18.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.078 0.942 . . . . 0.0 111.749 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.52 -36.13 68.84 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.859 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.37 -9.27 67.94 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -108.01 -174.26 2.48 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.131 0.491 . . . . 0.0 110.428 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 30.4 t -166.98 36.1 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.42 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttp 46.97 28.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.877 0.37 . . . . 0.0 110.516 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 42.4 tp -57.71 -53.59 56.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.183 0.516 . . . . 0.0 110.679 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 55.18 77.22 0.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.661 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -133.47 -12.79 2.69 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.535 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.461 ' O ' ' CE1' ' B' ' 78' ' ' HIS . 8.6 m80 68.54 -56.97 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.392 . . . . 0.0 110.498 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 54.32 88.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.307 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.461 ' CE1' ' O ' ' B' ' 76' ' ' HIS . 66.5 m80 -145.53 147.62 32.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.588 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 53.01 176.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.684 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.644 179.985 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.4 p -167.53 88.92 0.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.602 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -129.5 61.33 1.55 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.594 0.712 . . . . 0.0 111.097 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.55 ' CD2' ' H ' ' A' ' 4' ' ' LEU . 0.4 OUTLIER -83.87 74.62 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.579 179.07 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -63.58 -38.93 93.0 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.055 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p -82.88 127.21 33.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.249 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.587 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.1 t -67.33 -39.17 18.89 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.998 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -52.93 -21.67 16.25 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.896 1.731 . . . . 0.0 112.087 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.22 -43.86 90.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 110.635 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.454 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -64.01 -44.27 93.11 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.584 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 14' ' ' LEU . 25.1 mt -66.77 -42.26 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.519 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -49.42 -26.06 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.251 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.13 -33.34 70.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.402 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ILE . 36.4 mt -72.15 -37.41 69.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.594 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.48 -38.98 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.136 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -65.55 -35.6 81.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.451 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.09 -51.42 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.654 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.4 pt -74.45 -43.91 48.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.179 0.514 . . . . 0.0 111.025 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -64.73 -52.15 58.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.543 -179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 35.7 mtt -104.75 -161.92 0.85 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.198 0.523 . . . . 0.0 110.022 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -150.78 47.91 0.86 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -57.14 -49.58 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.517 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.4 p -175.45 68.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.496 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -167.12 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.4 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -158.35 -166.25 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.121 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -80.91 -106.07 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.552 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.564 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.3 tt -64.57 -37.14 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 120.954 0.407 . . . . 0.0 110.568 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.85 9.79 0.08 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.588 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.564 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.07 -42.64 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -62.01 -47.05 86.52 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.166 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.643 ' ND2' ' HE ' ' B' ' 35' ' ' ARG . 36.8 t-20 -51.9 -43.71 63.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.481 -178.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.8 m -71.11 -54.11 12.25 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.959 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.454 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 49.5 t80 -61.25 -43.79 98.3 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.746 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 30' ' ' MET . 39.2 t80 -58.56 -47.97 82.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.797 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.45 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 81.3 mtp180 -69.16 -27.67 65.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.376 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.7 t -66.46 -46.68 75.58 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.541 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.1 t -68.28 -45.87 81.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.513 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.5 t -51.87 -47.85 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.411 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 t -57.32 -42.66 82.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.435 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.9 m -64.88 -45.28 86.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.941 0.4 . . . . 0.0 110.746 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.58 -47.17 85.17 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.614 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.5 t -71.68 -38.33 66.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.781 0.325 . . . . 0.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -71.76 -33.28 68.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.637 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 1.129 ' O ' ' O ' ' A' ' 45' ' ' GLN . 30.5 m-20 -74.59 173.83 9.88 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 1.129 ' O ' ' O ' ' A' ' 44' ' ' ASP . 15.3 pt20 5.64 -164.01 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 117.472 -1.251 . . . . 0.0 113.268 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.11 28.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.553 1.069 . . . . 0.0 109.769 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.2 t -60.28 -42.57 95.72 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.334 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.556 ' O ' HG22 ' A' ' 51' ' ' VAL . 82.5 tttt -162.82 135.41 5.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.429 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -62.22 -10.17 9.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.533 0.683 . . . . 0.0 111.521 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.525 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -73.88 -51.69 15.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.149 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 48' ' ' LYS . 12.0 m -59.26 -56.44 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.524 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.517 ' N ' ' CG2' ' A' ' 51' ' ' VAL . 4.3 m -51.81 -33.19 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-O 121.379 0.609 . . . . 0.0 110.391 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 tt -74.68 -29.66 61.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.549 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.454 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 11.2 pttm -51.99 -37.89 54.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.619 0.724 . . . . 0.0 110.315 -179.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -75.71 -37.2 59.65 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.308 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 67.7 mt -58.66 -50.61 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.14 -179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -58.62 -37.05 75.04 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.454 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 9.0 m-70 -74.55 -39.75 62.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.368 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.4 -34.74 58.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.346 -178.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -50.26 -26.19 4.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.551 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.99 -37.85 83.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.781 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.97 -49.51 28.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -39.46 34.21 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.938 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -64.74 -41.04 96.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.444 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -64.26 -33.11 75.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.307 179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.04 -42.78 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-O 121.695 0.759 . . . . 0.0 110.344 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 18.4 mmmt -66.68 -46.86 74.26 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.163 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -78.05 -14.66 59.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.339 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.84 -40.22 5.32 Favored Glycine 0 N--CA 1.47 0.932 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -71.15 -31.05 67.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 110.422 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 p -140.36 112.52 7.74 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.401 0.619 . . . . 0.0 110.762 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.1 -113.74 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.271 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.1 mt -106.32 45.18 0.99 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.375 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -89.34 -26.33 21.15 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.572 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.9 m170 53.91 79.19 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.504 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -73.3 -7.44 51.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.555 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.476 ' CG ' ' N ' ' A' ' 78' ' ' HIS . 57.4 t-80 -156.51 166.05 34.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.573 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.476 ' N ' ' CG ' ' A' ' 77' ' ' HIS . 78.8 m80 -72.22 151.55 42.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 80' ' ' HIS . 58.8 t-80 -162.78 133.52 4.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.53 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' A' ' 79' ' ' HIS . 80.1 m80 . . . . . 0 C--O 1.221 -0.401 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.46 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.517 ' SD ' ' N ' ' B' ' 1' ' ' MET . 2.3 mpt? . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' SER . . . . . 0.439 ' C ' ' H ' ' B' ' 4' ' ' LEU . 8.2 m 59.38 142.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.716 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -79.02 35.31 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.956 0.408 . . . . 0.0 110.523 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.439 ' H ' ' C ' ' B' ' 2' ' ' SER . 34.2 mt 49.39 19.08 0.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.633 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -69.8 -36.46 75.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.373 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -81.49 135.83 35.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.096 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.7 t -71.02 -39.96 9.03 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.892 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 64.6 Cg_exo -52.42 -15.77 4.34 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.987 1.792 . . . . 0.0 112.034 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -67.57 -51.57 49.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.944 0.402 . . . . 0.0 110.378 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.91 -40.82 96.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.311 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -63.12 -42.8 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.509 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -49.13 -23.78 1.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.586 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.417 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.468 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 7.1 mp -70.15 -39.72 75.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.533 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -57.14 -31.58 65.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.046 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.97 -35.39 80.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.52 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -62.58 -52.05 64.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.879 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.7 -43.87 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.408 0.623 . . . . 0.0 110.806 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -63.91 -23.8 67.49 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.473 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 36.6 mtt -138.6 -146.89 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.109 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -170.08 39.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.223 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . 0.429 ' O ' ' OG ' ' B' ' 23' ' ' SER . 1.1 tm0? -50.99 -40.2 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.967 0.413 . . . . 0.0 110.756 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 5.0 m -177.46 64.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.185 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -164.66 -135.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.312 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -157.23 -161.31 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.26 0.552 . . . . 0.0 110.318 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -86.49 -103.59 0.07 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.352 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' B' ' 29' ' ' ALA . 44.8 mm -64.6 -40.99 90.97 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -61.16 3.39 0.1 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.789 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -74.08 -44.87 52.45 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.55 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.576 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.83 -47.23 84.29 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.25 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.576 ' N ' ' SD ' ' B' ' 30' ' ' MET . 2.0 t30 -54.97 -53.36 56.66 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.714 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -62.49 -53.29 57.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.833 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -60.38 -49.08 78.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.495 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' B' ' 30' ' ' MET . 35.3 t80 -57.86 -54.56 45.48 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.794 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.643 ' HE ' ' ND2' ' A' ' 31' ' ' ASN . 6.9 tmm_? -61.63 -32.73 72.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 121.155 0.503 . . . . 0.0 110.429 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -68.75 -44.14 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.771 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 38.5 t -66.59 -63.95 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.646 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.44 ' CG2' ' N ' ' B' ' 39' ' ' SER . 20.2 m -48.5 -45.87 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.518 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.44 ' N ' ' CG2' ' B' ' 38' ' ' VAL . 46.1 t -60.15 -41.08 91.98 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.281 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -69.0 -49.21 59.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.968 0.413 . . . . 0.0 110.708 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.66 -40.4 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.514 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.433 ' O ' ' CG1' ' B' ' 42' ' ' VAL . 60.7 t -85.1 19.76 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.076 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -162.12 21.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -161.98 14.14 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -172.6 55.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.545 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 mt -87.67 48.63 1.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.409 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -72.28 -27.17 62.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.31 0.576 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -172.32 133.74 0.67 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.868 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.424 ' O ' ' HB2' ' B' ' 53' ' ' LEU . 10.0 m120 -52.38 -42.87 64.35 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.465 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.59 86.99 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.939 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -51.97 -44.23 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.434 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.46 -39.75 23.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.185 0.516 . . . . 0.0 110.642 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' B' ' 49' ' ' ASN . 0.2 OUTLIER -55.44 -58.62 7.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.912 -178.4 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -55.71 -37.96 69.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.365 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -64.2 -41.34 97.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.481 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.425 ' O ' ' N ' ' B' ' 59' ' ' LEU . 94.3 mt -65.74 -49.0 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.264 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -49.41 -30.85 8.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.237 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -71.42 -29.24 64.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' B' ' 56' ' ' ILE . 0.4 OUTLIER -77.46 -26.32 51.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.125 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -61.94 -54.6 39.54 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.455 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -62.35 -26.45 68.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.703 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -52.09 17.62 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 120.826 0.346 . . . . 0.0 110.851 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.433 ' CD1' ' C ' ' B' ' 63' ' ' TYR . 0.0 OUTLIER -53.35 -44.68 68.7 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.017 -179.661 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -66.58 -31.17 71.7 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.159 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -63.61 -31.27 72.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.531 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -63.75 -55.44 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.3 0.572 . . . . 0.0 110.656 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -69.8 -46.37 65.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.347 1.07 . . . . 0.0 111.881 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -44.27 -35.93 2.52 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.068 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.49 -55.76 4.15 Favored Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -47.05 -84.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.642 0.258 . . . . 0.0 110.844 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.441 ' HG ' ' H ' ' B' ' 72' ' ' LYS . 25.2 t 51.27 -151.29 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.081 0.467 . . . . 0.0 110.442 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.441 ' H ' ' HG ' ' B' ' 71' ' ' SER . 17.9 mmmt -56.63 -69.74 0.14 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.648 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.37 129.1 0.35 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.961 0.41 . . . . 0.0 110.3 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -143.56 24.09 1.75 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.464 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 81.8 t60 -89.79 115.87 27.46 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.039 0.447 . . . . 0.0 110.375 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -72.78 131.81 42.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.503 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -76.35 148.31 37.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.354 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -137.21 121.54 18.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.609 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -64.31 -47.01 81.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.428 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 p80 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.522 -179.908 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.523 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.5 t 55.33 172.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -68.99 178.78 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.315 0.579 . . . . 0.0 110.069 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' A' ' 5' ' ' PHE . 5.4 mp -74.3 -93.89 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.678 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.492 ' O ' ' CB ' ' A' ' 6' ' ' SER . 87.2 t80 36.78 74.33 0.08 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.497 0.665 . . . . 0.0 110.9 -179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.521 ' O ' ' N ' ' A' ' 9' ' ' TYR . 3.2 t 151.24 72.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.063 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.439 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -34.22 -53.03 0.93 Allowed Pre-proline 0 N--CA 1.482 1.171 0 CA-C-N 118.225 0.466 . . . . 0.0 111.146 178.276 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 11.3 Cg_endo -51.29 -21.17 9.31 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 120.407 0.738 . . . . 0.0 112.671 178.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.521 ' N ' ' O ' ' A' ' 6' ' ' SER . 7.3 t80 -62.2 -42.96 99.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.341 0.591 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.1 -52.49 6.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.879 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.2 mt -53.66 -35.85 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.601 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -49.3 -31.07 8.37 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.22 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.476 ' OD1' ' NE2' ' A' ' 17' ' ' HIS . 53.4 t-20 -72.37 -45.34 60.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.211 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 56.5 mt -61.45 -42.5 98.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.613 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.31 -38.84 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -69.04 -33.92 74.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.685 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.476 ' NE2' ' OD1' ' A' ' 13' ' ' ASN . 8.8 m-70 -63.62 -51.74 63.92 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.715 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.5 pt -70.17 -42.54 79.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.119 0.485 . . . . 0.0 110.938 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -57.63 -52.2 66.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.206 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 63.6 mtm -114.29 -125.53 0.28 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.432 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -170.07 61.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.396 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.19 51.74 0.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.968 0.889 . . . . 0.0 110.91 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 23' ' ' SER . 3.4 p 77.42 46.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.257 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -147.18 -142.88 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.627 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -153.54 -168.28 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.234 0.54 . . . . 0.0 110.657 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.33 -100.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.176 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.671 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.0 tp -63.53 -42.45 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -63.82 19.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.873 0.368 . . . . 0.0 110.99 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.671 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -79.73 -46.7 16.57 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.268 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.564 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -64.98 -50.64 65.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.252 -179.2 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.478 ' N ' ' SD ' ' A' ' 30' ' ' MET . 82.5 m-20 -51.41 -38.55 54.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.453 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 t -77.2 -54.26 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.615 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.443 ' O ' ' OG ' ' A' ' 36' ' ' SER . 58.4 t80 -63.95 -47.69 79.45 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.18 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.564 ' N ' ' O ' ' A' ' 30' ' ' MET . 57.7 t80 -55.56 -51.77 65.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.751 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.6 ttt85 -63.35 -34.73 78.35 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 33' ' ' TYR . 52.7 p -63.93 -42.52 97.33 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.364 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.98 -56.83 9.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.376 -0.529 . . . . 0.0 110.171 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.7 t -50.01 -45.35 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.417 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.1 m -68.69 -18.74 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.668 0.27 . . . . 0.0 110.416 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.512 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.4 m -88.63 -54.31 4.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.066 0.46 . . . . 0.0 110.961 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.5 mt -61.5 -39.5 91.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.445 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 p -69.31 -25.53 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.4 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -98.75 -22.13 16.03 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.191 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 40' ' ' THR . 14.3 m-20 -91.04 -34.77 14.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.948 0.404 . . . . 0.0 110.518 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.41 HE22 ' CZ ' ' A' ' 55' ' ' ARG . 9.5 tt0 -106.98 161.6 14.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.374 0.607 . . . . 0.0 110.211 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -168.27 22.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.367 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 49.9 m -61.5 -42.99 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.467 0.651 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -173.86 141.51 0.81 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.703 -179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -48.78 -38.39 21.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.38 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.03 -50.16 51.1 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.351 -0.539 . . . . 0.0 110.765 179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.439 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 37.5 t -52.41 -43.57 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.499 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.4 m -78.69 -37.92 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.242 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -62.28 -46.29 89.42 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.098 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 17.9 ptmt -54.85 -40.93 70.15 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.03 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.416 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 93.1 mtt180 -63.95 -39.54 94.38 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.824 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.9 mt -69.06 -48.66 68.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.6 -34.4 71.08 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.411 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 51.0 m170 -76.56 -43.14 40.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.871 0.367 . . . . 0.0 110.358 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.4 tp -48.76 -22.63 0.84 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.447 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 10.8 p-10 -58.6 -26.66 63.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.021 0.438 . . . . 0.0 110.416 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 10.4 pt-20 -60.85 -38.63 86.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.407 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.28 -55.06 10.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.401 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.665 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -51.23 -46.07 62.17 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.264 0.554 . . . . 0.0 110.211 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -61.66 -33.09 73.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.128 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.6 tptm -62.8 -39.61 94.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.85 -48.72 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.339 0.59 . . . . 0.0 110.132 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -42.71 93.54 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 122.016 0.912 . . . . 0.0 111.523 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -60.87 -34.85 75.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.942 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.2 -25.57 28.41 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 110.864 -0.895 . . . . 0.0 110.864 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -104.89 -160.71 0.77 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.131 0.491 . . . . 0.0 110.253 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 t 53.54 74.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.438 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -73.29 -28.63 62.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.482 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.62 ' O ' ' N ' ' A' ' 75' ' ' HIS . 7.7 tp -44.63 -63.66 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.433 0.635 . . . . 0.0 110.857 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 55.92 -71.1 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.801 0.81 . . . . 0.0 110.834 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.62 ' N ' ' O ' ' A' ' 73' ' ' LEU . 30.2 p-80 -167.1 160.76 14.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.708 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -64.52 138.41 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.406 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -61.68 138.48 58.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.434 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -73.1 153.87 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.457 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -144.6 146.94 32.57 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.58 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.609 ' N ' ' HD1' ' A' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.398 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 79.2 p -74.57 157.4 35.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -65.32 157.19 29.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.278 0.561 . . . . 0.0 110.54 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 40.8 mt -64.2 -41.5 97.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.736 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . 0.467 ' O ' ' CB ' ' B' ' 6' ' ' SER . 83.3 t80 -48.57 105.49 0.08 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.837 0.827 . . . . 0.0 110.252 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' B' ' 5' ' ' PHE . 1.0 OUTLIER 161.25 97.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.472 179.601 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.496 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 18.7 t -46.22 -43.27 32.7 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.369 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 23.8 Cg_exo -66.16 -20.75 56.19 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 120.401 0.734 . . . . 0.0 111.805 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.52 -57.43 3.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.341 0.591 . . . . 0.0 110.942 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -43.91 -47.45 8.4 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.622 -178.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 70.4 mt -66.46 -48.19 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.38 0.61 . . . . 0.0 111.234 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.24 -27.82 0.7 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.716 -178.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' B' ' 17' ' ' HIS . 18.9 m120 -75.13 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.307 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 34.8 mt -61.63 -43.25 99.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.225 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -59.06 -44.03 91.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 20' ' ' MET . 56.5 tt0 -67.57 -29.5 68.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.89 0.376 . . . . 0.0 110.245 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' B' ' 13' ' ' ASN . 47.8 m170 -67.95 -53.69 24.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -72.97 -43.48 58.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.132 0.492 . . . . 0.0 110.707 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -69.56 -48.36 60.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.353 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.437 ' CB ' ' O ' ' B' ' 16' ' ' GLN . 3.9 tpp -99.94 -163.7 1.05 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.357 0.599 . . . . 0.0 110.19 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -155.78 41.55 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.436 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -58.88 -49.2 78.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.469 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -175.45 69.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -163.8 -148.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.083 0.468 . . . . 0.0 110.201 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -142.76 -164.46 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.363 0.601 . . . . 0.0 110.43 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -88.81 -104.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.441 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 7.0 tp -61.05 -40.67 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -60.02 -14.5 16.59 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.261 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.97 -45.08 51.21 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.525 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 14.0 ptt? -63.4 -52.14 62.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.316 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.525 ' N ' ' CG ' ' B' ' 30' ' ' MET . 97.8 m-20 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.775 -178.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.6 t -63.11 -45.33 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.57 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -75.25 -46.75 31.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.804 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.434 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.2 t80 -49.02 -51.3 31.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.766 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.665 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 67.5 ttt-85 -66.41 -28.94 69.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 5.6 t -62.27 -44.23 97.01 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' B' ' 41' ' ' LEU . 66.4 t -70.79 -58.92 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.862 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -49.43 -49.26 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.763 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 59.7 p -49.04 -61.26 2.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.383 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -73.0 -44.66 60.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 122.443 1.116 . . . . 0.0 111.534 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' B' ' 37' ' ' VAL . 53.6 tp -53.53 -28.51 31.77 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.512 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.459 ' O ' ' CG1' ' B' ' 42' ' ' VAL . 96.1 t -96.48 21.9 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.16 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -138.05 -2.29 1.89 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.457 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -101.83 -38.62 7.76 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 110.358 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -110.29 174.13 6.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.522 0.677 . . . . 0.0 110.018 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -178.61 26.3 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.208 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -71.7 -34.18 69.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.357 0.598 . . . . 0.0 110.725 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 tptm -169.35 129.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.621 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -49.43 -32.38 11.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.232 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.52 -50.77 34.2 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.318 0.58 . . . . 0.0 110.702 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.9 t -49.49 -43.67 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.447 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -75.98 -36.63 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 120.159 -0.616 . . . . 0.0 111.028 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.51 -35.61 81.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.648 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 65.2 mttm -54.6 -44.63 73.23 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.204 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -69.77 -40.78 75.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 80.1 mt -63.67 -54.65 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.801 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.15 -34.13 69.94 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 5.1 m-70 -76.61 -42.47 42.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.478 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 57.1 tp -47.07 -22.15 0.32 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.583 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 21.7 p-10 -58.94 -28.23 66.06 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.372 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 12.5 pt-20 -56.86 -40.48 76.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.343 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -51.44 32.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.571 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -39.21 15.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 121.035 0.445 . . . . 0.0 109.926 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.42 -34.17 77.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.561 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 tptt -57.32 -42.95 82.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.455 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.41 -47.3 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 122.286 1.041 . . . . 0.0 110.718 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.37 92.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.893 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 -67.02 -16.04 64.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.065 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.52 -63.98 1.12 Allowed Glycine 0 N--CA 1.463 0.441 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.663 ' CG ' ' H ' ' B' ' 71' ' ' SER . 0.0 OUTLIER -50.44 -94.49 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 110.626 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.663 ' H ' ' CG ' ' B' ' 70' ' ' GLU . 96.0 p 47.61 -160.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.1 0.476 . . . . 0.0 110.515 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -94.08 -37.08 11.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.567 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 15.9 mt -77.94 130.2 36.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.481 0.657 . . . . 0.0 110.126 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -137.17 66.13 1.47 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.338 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' B' ' 77' ' ' HIS . 53.4 t60 -76.64 128.91 35.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.246 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 98.3 m-70 -157.49 -56.02 0.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.492 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.535 ' N ' ' HD1' ' B' ' 77' ' ' HIS . 1.5 m80 58.6 140.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.609 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -72.6 154.04 40.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.859 0.362 . . . . 0.0 110.375 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -63.63 138.84 58.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.422 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 C--O 1.219 -0.506 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.706 -179.986 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -167.48 71.78 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 0.0 110.62 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -90.0 82.54 6.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.336 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.6 mt -66.28 -24.04 66.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.335 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -59.07 -45.33 91.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.247 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.3 p -76.36 126.67 31.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.514 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.567 ' CG2' ' HE2' ' A' ' 58' ' ' HIS . 78.1 t -59.47 -44.84 98.58 Favored Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-O 119.036 -0.506 . . . . 0.0 109.858 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -44.7 -31.72 5.25 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.241 1.294 . . . . 0.0 112.317 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.55 -43.05 89.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.923 0.392 . . . . 0.0 110.237 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -66.1 -45.54 80.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.458 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.34 -50.44 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.92 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -47.29 -39.94 15.73 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.676 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -51.84 -30.49 23.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.315 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.58 -41.22 63.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.568 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -54.78 -34.13 62.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 120.92 0.391 . . . . 0.0 110.177 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -64.34 -27.44 69.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.333 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.422 ' O ' ' CA ' ' A' ' 21' ' ' ASN . 2.0 m-70 -71.71 -52.86 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.6 pt -73.98 -38.19 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.446 0.641 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -62.58 -44.67 95.73 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.691 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.443 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 28.8 ttp -114.96 -65.06 1.23 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.294 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.443 ' CB ' ' O ' ' A' ' 20' ' ' MET . 5.6 t30 81.48 45.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -55.18 -37.41 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.166 0.507 . . . . 0.0 110.556 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.1 m -158.12 63.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.643 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.419 ' CG ' ' H ' ' A' ' 25' ' ' ASP . 1.9 tp10 -159.66 -130.93 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.981 0.419 . . . . 0.0 110.491 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 65.3 m-20 -159.39 167.66 28.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.197 0.523 . . . . 0.0 110.429 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -69.9 -99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.454 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.604 ' C ' ' H ' ' A' ' 29' ' ' ALA . 10.7 tp -61.14 -43.15 95.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.015 0.436 . . . . 0.0 110.637 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.423 ' N ' ' CG2' ' A' ' 27' ' ' ILE . 94.8 m-70 -67.72 17.91 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.642 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.604 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -58.97 -51.93 67.96 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.527 ' O ' ' N ' ' A' ' 34' ' ' TYR . 66.9 mmm -61.68 -44.55 96.74 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.106 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -46.55 -33.69 4.3 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.562 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 m -89.15 -57.11 3.01 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.913 0.387 . . . . 0.0 110.736 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CE2' ' A' ' 10' ' ' PHE . 38.6 t80 -61.37 -53.06 61.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 28.0 t80 -49.01 -49.55 40.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.234 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -66.5 -28.56 68.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.301 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.5 t -63.4 -46.18 87.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.359 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.551 ' O ' ' N ' ' A' ' 41' ' ' LEU . 35.3 t -71.0 -56.34 10.95 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.5 t -51.36 -47.67 34.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.454 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 p -53.82 -60.28 3.52 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.085 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.1 m -69.49 -44.58 70.81 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.919 0.866 . . . . 0.0 111.045 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.551 ' N ' ' O ' ' A' ' 37' ' ' VAL . 41.8 tp -56.26 -27.77 56.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.598 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 98.6 t -101.87 -33.64 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.205 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -80.16 -0.29 35.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.339 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 43.5 t0 -145.46 165.16 29.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.37 0.605 . . . . 0.0 110.252 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.442 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.3 tt0 72.42 -78.28 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.606 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt 42.09 41.15 1.9 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.4 t -73.4 -34.61 65.6 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.397 0.618 . . . . 0.0 110.79 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -167.49 133.68 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.784 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.41 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.9 m120 -49.72 -47.07 50.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.664 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.61 83.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.774 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.0 t -52.96 -43.84 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.547 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 56' ' ' ILE . 28.8 m -81.1 -46.33 20.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.161 0.505 . . . . 0.0 110.556 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' CD1' HE21 ' A' ' 57' ' ' GLN . 0.2 OUTLIER -57.15 -55.94 28.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.808 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 17.4 ptmt -50.99 -40.02 57.04 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.236 0.541 . . . . 0.0 110.411 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.439 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 40.0 ttm180 -65.08 -39.18 92.84 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.147 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 52' ' ' VAL . 34.3 mm -61.36 -52.95 55.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.247 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.496 HE21 ' CD1' ' A' ' 53' ' ' LEU . 75.8 mt-30 -52.52 -40.97 63.03 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.567 ' HE2' ' CG2' ' A' ' 7' ' ' VAL . 2.8 t-80 -66.97 -46.16 75.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.11 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 29.3 tp -53.0 -23.65 7.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.917 0.389 . . . . 0.0 110.598 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -55.64 -49.26 73.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.434 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 6.2 pt-20 -50.74 -28.59 9.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.684 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.56 -62.22 1.49 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.34 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.43 ' CE2' ' OD1' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -52.47 -38.89 60.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.038 0.447 . . . . 0.0 110.25 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 68' ' ' ARG . 61.4 m-80 -65.32 -27.64 68.74 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.165 -179.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -75.88 -39.74 55.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.475 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -63.03 -52.05 64.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.587 -179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -63.26 -44.96 93.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.801 0.81 . . . . 0.0 111.072 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 64' ' ' ASN . 12.1 mmm180 -55.34 -31.38 61.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.981 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.96 -22.31 61.53 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -85.94 -168.04 2.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.391 . . . . 0.0 110.546 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.471 ' O ' ' C ' ' A' ' 72' ' ' LYS . 68.3 m -91.21 54.3 2.55 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.176 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.471 ' C ' ' O ' ' A' ' 71' ' ' SER . 47.7 mtpt 29.42 -125.23 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.1 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' A' ' 75' ' ' HIS . 24.6 mt -95.54 17.24 15.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.159 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 52.62 11.52 0.19 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.087 0.47 . . . . 0.0 110.557 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.464 ' H ' ' C ' ' A' ' 73' ' ' LEU . 98.5 m-70 52.0 177.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.557 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -155.82 9.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.492 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 84.4 t60 51.11 98.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 52.3 p-80 -63.92 179.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.568 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.423 ' O ' ' CG ' ' A' ' 79' ' ' HIS . 6.3 p80 -161.44 84.87 0.64 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.415 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.734 179.826 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -66.54 134.98 53.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.439 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -84.18 137.99 33.22 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.272 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.86 -35.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.527 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -60.66 -44.38 96.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.237 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p -66.51 125.87 27.09 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.405 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.549 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -57.32 -42.61 96.9 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.967 179.107 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.9 Cg_exo -50.16 -31.16 27.74 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 121.737 1.624 . . . . 0.0 112.097 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -59.98 -43.87 94.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 110.339 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.469 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -63.79 -46.43 85.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.215 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.3 mt -61.11 -47.04 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-O 121.052 0.453 . . . . 0.0 110.587 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -48.43 -35.0 11.91 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -58.39 -34.31 70.59 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' B' ' 14' ' ' LEU . 6.6 mp -72.44 -37.23 68.62 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.246 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.82 -38.32 87.7 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.329 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -54.26 -24.93 20.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.556 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.425 ' O ' ' CA ' ' B' ' 21' ' ' ASN . 28.3 m170 -76.38 -54.62 6.49 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -70.84 -38.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.483 0.659 . . . . 0.0 110.625 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -63.72 -43.0 97.83 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 48.9 mtt -115.56 -65.16 1.22 Allowed 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.066 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.444 ' CB ' ' O ' ' B' ' 20' ' ' MET . 24.3 t30 82.9 46.78 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.831 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.7 -40.98 85.22 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.411 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -158.57 69.81 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.576 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -165.17 -125.32 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.076 0.465 . . . . 0.0 110.338 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -158.17 -175.92 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.33 0.586 . . . . 0.0 110.048 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -86.4 -98.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.465 ' C ' ' H ' ' B' ' 29' ' ' ALA . 4.3 mm -61.71 -43.16 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.436 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -62.14 -0.58 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.74 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.465 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.29 -49.86 74.73 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.114 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -68.67 -40.51 80.09 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.283 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' B' ' 30' ' ' MET . 40.7 t30 -55.54 -50.62 69.54 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.668 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.2 t -67.01 -51.45 54.75 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.696 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.469 ' OH ' ' CE2' ' B' ' 10' ' ' PHE . 54.1 t80 -61.43 -50.0 74.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.478 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.474 ' N ' ' O ' ' B' ' 30' ' ' MET . 39.4 t80 -55.98 -48.48 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.104 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -64.87 -34.36 78.19 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.857 0.361 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' SER . . . . . 0.434 ' OG ' ' O ' ' B' ' 33' ' ' TYR . 59.2 p -67.75 -39.07 84.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.646 -179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 43.0 t -68.97 -63.45 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.401 -179.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 23.7 m -50.55 -42.31 21.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.369 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 62.2 p -62.05 -46.23 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.419 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.1 m -63.65 -44.28 94.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.399 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.504 ' O ' ' O ' ' B' ' 44' ' ' ASP . 90.4 mt -70.37 -50.67 36.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.705 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 62.8 t -60.91 -19.19 19.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.082 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -103.62 6.69 37.3 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.855 0.36 . . . . 0.0 110.854 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.504 ' O ' ' O ' ' B' ' 41' ' ' LEU . 39.7 t0 -148.35 170.12 18.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.606 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . 0.421 HE22 HH12 ' B' ' 55' ' ' ARG . 5.4 pt20 39.88 48.28 2.01 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.352 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.37 46.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.353 -179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' THR . . . . . 0.403 ' H ' ' C ' ' B' ' 45' ' ' GLN . 3.6 t -61.04 -41.16 96.05 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.204 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 tptt -167.32 134.43 2.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.754 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -50.24 -37.51 36.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.539 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.98 -51.27 68.76 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.49 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 36.7 t -50.61 -38.65 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.988 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 5.2 t -80.76 -43.06 20.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.597 0.713 . . . . 0.0 111.008 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.93 -52.75 62.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.141 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.48 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 49.9 pttt -51.34 -42.39 61.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.48 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 78.3 mtp180 -65.71 -45.35 83.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.336 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.78 -54.83 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.739 -0.385 . . . . 0.0 110.362 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -53.2 -40.21 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.313 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 57.0 m170 -75.21 -38.27 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.275 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 52.8 tp -51.75 -32.28 30.03 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.63 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.95 -29.03 11.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.482 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -56.69 -35.57 68.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.6 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -60.83 2.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.486 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -43.43 22.22 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.961 0.41 . . . . 0.0 110.158 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -62.05 -39.66 93.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.293 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 tptm -66.74 -36.63 82.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.441 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.4 -51.07 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.232 0.539 . . . . 0.0 110.355 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -66.33 -48.39 70.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.267 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -61.08 -21.64 63.87 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.219 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.6 -27.11 48.52 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.482 ' O ' ' N ' ' B' ' 72' ' ' LYS . 36.8 mm-40 -70.66 -115.7 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 2.8 t 66.26 -64.43 0.22 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.677 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' B' ' 70' ' ' GLU . 99.7 mttt 53.02 33.97 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.374 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.25 -56.9 13.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.97 -179.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.403 ' HG3' ' H ' ' B' ' 75' ' ' HIS . 2.3 pt-20 -51.13 -96.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.403 ' H ' ' HG3' ' B' ' 74' ' ' GLU . 83.2 t60 -159.11 152.21 22.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.198 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.646 ' CG ' ' H ' ' B' ' 77' ' ' HIS . 78.9 t60 -157.24 178.67 10.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.192 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.646 ' H ' ' CG ' ' B' ' 76' ' ' HIS . 33.4 p-80 -148.63 165.71 30.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.461 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.422 ' HE2' ' HZ3' ' B' ' 72' ' ' LYS . 70.1 m80 -137.15 136.73 38.5 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.436 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 77.1 m80 47.13 63.19 2.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.702 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.0 t60 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.379 -179.81 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m -72.32 144.32 48.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.37 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -74.35 125.58 28.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.15 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.406 ' C ' ' H ' ' A' ' 6' ' ' SER . 50.7 mt 45.26 -152.37 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.516 179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 32.8 t80 68.22 -50.02 0.55 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.117 0.484 . . . . 0.0 110.573 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.406 ' H ' ' C ' ' A' ' 4' ' ' LEU . 0.1 OUTLIER -52.16 102.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.208 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.492 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.0 t -47.56 -42.64 44.77 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 118.854 -0.593 . . . . 0.0 110.245 179.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 37.8 Cg_exo -58.62 -22.89 62.71 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 120.754 0.97 . . . . 0.0 111.86 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.77 -48.35 77.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.912 0.387 . . . . 0.0 110.547 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.471 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.4 m-85 -48.83 -45.3 40.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.297 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 14' ' ' LEU . 45.9 mt -70.21 -50.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.695 0.76 . . . . 0.0 110.833 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -48.41 -24.13 1.15 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.412 -178.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -72.3 -36.47 68.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.45 . . . . 0.0 110.179 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 11' ' ' ILE . 17.0 mt -70.52 -48.12 57.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.387 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -59.02 -27.8 65.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.287 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -62.53 -27.52 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.18 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.472 ' CE1' ' C ' ' A' ' 24' ' ' GLU . 48.5 t60 -81.86 -60.69 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.488 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -50.9 -39.06 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.836 0.827 . . . . 0.0 110.259 -179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -72.21 -32.15 66.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.458 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.54 -121.77 0.15 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -174.61 72.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.357 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.432 ' O ' ' OG ' ' A' ' 23' ' ' SER . 68.1 tp60 -77.21 -54.98 5.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.13 0.49 . . . . 0.0 110.198 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' ' 22' ' ' GLN . 1.9 m 170.61 78.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.367 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' C ' ' CE1' ' A' ' 17' ' ' HIS . 21.3 tp10 -170.68 -131.54 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.288 0.565 . . . . 0.0 110.219 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 17' ' ' HIS . 71.5 m-20 -152.23 176.53 11.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.3 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -72.89 -102.47 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.506 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.441 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.9 mm -64.29 -41.49 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -55.43 -9.23 0.44 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.204 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.441 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -51.88 -42.64 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.513 ' CG ' ' N ' ' A' ' 31' ' ' ASN . 11.6 ptt? -66.05 -54.62 23.56 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.513 ' N ' ' CG ' ' A' ' 30' ' ' MET . 61.6 t-20 -57.3 -55.01 40.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.649 -178.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -56.39 -51.43 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.642 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.471 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 58.5 t80 -63.02 -47.16 84.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -53.4 -43.88 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.864 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -74.73 -28.32 60.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.827 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 p -64.51 -44.91 89.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.43 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.1 t -72.01 -54.18 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.3 t -48.53 -47.01 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 -179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.7 t -56.65 -46.94 80.77 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.277 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.4 m -64.57 -45.4 87.2 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.41 0.624 . . . . 0.0 111.272 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.06 -37.83 88.83 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.726 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.409 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 48.5 t -92.9 25.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.695 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -147.49 -0.89 0.64 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.45 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 46' ' ' LEU . 73.4 m-20 -145.41 170.83 15.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.309 0.576 . . . . 0.0 110.288 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 62.35 -71.56 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.428 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' ASP . 15.8 mt 44.53 70.45 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.277 0.561 . . . . 0.0 110.604 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -109.53 -31.12 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.439 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -171.6 129.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.65 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -49.15 -38.8 26.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.513 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.8 76.92 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.847 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.6 t -54.48 -55.14 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.418 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.64 -40.71 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.257 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 66.0 tp -60.96 -43.1 99.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.359 -179.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 51.1 mtpt -56.66 -41.19 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.08 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -64.41 -39.9 94.75 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 89.9 mt -69.09 -51.92 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -55.42 -38.44 68.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.143 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 5.5 m-70 -73.36 -22.62 60.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.02 -34.24 77.14 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 41.0 p-10 -47.2 -25.48 0.93 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.013 0.435 . . . . 0.0 110.381 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.451 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 12.6 pt-20 -58.76 -40.1 82.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.331 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.93 -58.05 4.67 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.395 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -46.19 -43.51 15.31 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.139 0.495 . . . . 0.0 110.076 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.98 -44.69 88.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.696 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -62.64 -39.31 93.46 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.915 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.17 -47.19 91.04 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.67 0 CA-C-O 121.855 0.836 . . . . 0.0 109.929 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -65.13 -43.74 90.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.353 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -74.33 -5.04 39.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.096 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.603 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -106.12 -77.57 1.11 Allowed Glycine 0 N--CA 1.46 0.291 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.603 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 pt-20 6.28 -101.65 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.529 -0.335 . . . . 0.0 111.637 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.43 ' H ' ' CG ' ' A' ' 70' ' ' GLU . 67.2 m -158.56 159.25 35.31 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.269 0.557 . . . . 0.0 109.745 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.559 ' C ' ' H ' ' A' ' 74' ' ' GLU . 27.1 ttmt -90.36 156.59 18.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.03 -179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 tp 68.1 -10.9 0.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.213 0.53 . . . . 0.0 110.797 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.559 ' H ' ' C ' ' A' ' 72' ' ' LYS . 86.7 mt-10 -100.91 61.61 0.97 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.37 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -110.21 152.91 25.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -76.1 134.03 40.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.501 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -70.15 137.12 50.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.439 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.703 ' HD1' ' H ' ' A' ' 80' ' ' HIS . 56.0 t-80 -151.45 174.01 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.499 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.563 ' H ' ' CG ' ' A' ' 78' ' ' HIS . 97.5 m-70 -58.53 -39.57 80.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.524 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.703 ' H ' ' HD1' ' A' ' 78' ' ' HIS . 13.8 p-80 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.438 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.401 ' H1 ' ' H ' ' B' ' 2' ' ' SER . 81.2 mmm . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' SER . . . . . 0.401 ' H ' ' H1 ' ' B' ' 1' ' ' MET . 93.7 p -64.88 149.72 49.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.536 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -91.19 93.94 9.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.34 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.417 ' N ' ' CD1' ' B' ' 4' ' ' LEU . 9.8 mp -71.0 -23.54 62.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.048 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.45 -43.08 88.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.184 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -62.86 123.04 17.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.316 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.539 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.76 -42.33 87.01 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.601 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 51.5 Cg_exo -54.07 -23.64 29.57 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 121.476 1.45 . . . . 0.0 112.094 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -67.01 -39.41 87.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.628 0.252 . . . . 0.0 110.573 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.463 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.37 -40.23 90.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.102 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . 0.45 ' O ' ' N ' ' B' ' 14' ' ' LEU . 96.8 mt -68.13 -45.66 82.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.512 0.672 . . . . 0.0 110.796 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -47.76 -25.16 1.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.327 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -73.94 -35.37 64.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.053 0.454 . . . . 0.0 110.166 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 11' ' ' ILE . 29.4 mt -70.89 -39.61 72.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.658 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -57.57 -35.55 70.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.099 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -71.33 -28.91 64.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.632 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 52.0 m170 -67.38 -49.88 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.66 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.86 -43.5 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -59.7 -51.55 69.32 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.373 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 52.1 mtm -118.73 -145.34 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.946 0.403 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -157.49 57.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.344 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 65.2 tp60 -61.11 -45.19 95.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.236 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 t 177.57 69.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -169.73 -133.24 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.402 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -151.01 -166.81 2.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.456 0.646 . . . . 0.0 110.269 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -82.23 -109.46 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.423 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 20.4 tt -65.36 -37.46 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 121.091 0.472 . . . . 0.0 110.552 -179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -57.37 -22.16 40.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.467 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.98 -33.76 2.16 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.611 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -66.18 -52.75 45.16 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.015 178.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.611 ' N ' ' SD ' ' B' ' 30' ' ' MET . 3.0 t-20 -55.35 -50.97 68.26 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.724 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.4 t -61.29 -48.34 81.85 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.463 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 60.0 t80 -70.25 -20.74 63.05 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 40.2 t80 -73.09 -53.1 11.91 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.297 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -68.83 -23.0 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.495 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -70.0 -47.61 61.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.581 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 66.8 t -70.13 -57.9 6.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.106 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 76.8 t -48.57 -44.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.428 -179.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 52.8 m -58.49 -34.21 70.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.842 0.353 . . . . 0.0 110.434 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.0 m -82.25 -45.96 14.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.759 0.79 . . . . 0.0 111.372 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.463 ' CD1' ' CZ ' ' B' ' 55' ' ' ARG . 3.2 mm? -64.21 -43.55 94.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.619 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 4.3 p -68.17 -20.4 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.054 0.455 . . . . 0.0 109.981 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -98.84 -15.6 19.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -55.64 -47.73 76.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -174.8 126.67 0.29 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 110.565 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 25.0 mt -97.31 39.14 1.2 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.258 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -63.69 -25.35 68.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.684 0.754 . . . . 0.0 110.322 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.497 ' O ' HG22 ' B' ' 51' ' ' VAL . 34.5 tptt -169.41 115.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.826 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 48.4 p30 -50.21 -14.29 0.15 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.174 -0.61 . . . . 0.0 110.985 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' B' ' 48' ' ' LYS . . . -78.31 -55.1 5.51 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 119.905 -0.718 . . . . 0.0 112.292 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . 0.497 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.3 m -48.35 -37.97 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.837 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.4 ' H ' HG22 ' B' ' 51' ' ' VAL . 27.3 m -76.35 -33.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.588 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.41 -38.33 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.363 -178.671 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -67.58 -47.15 70.57 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.338 0.59 . . . . 0.0 110.298 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.463 ' CZ ' ' CD1' ' B' ' 41' ' ' LEU . 54.8 mtp180 -61.8 -42.89 99.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.2 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.31 -45.02 94.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.218 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -52.11 -37.78 55.28 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.2 -33.84 76.24 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.02 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.45 -40.82 83.66 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.386 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -51.86 -27.25 12.07 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.961 0.41 . . . . 0.0 110.095 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.31 -40.94 98.73 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.34 -53.54 12.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.834 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.39 -43.05 44.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.058 0.456 . . . . 0.0 109.961 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -64.53 -34.77 79.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.137 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -63.68 -34.37 77.71 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.418 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 99.7 t -65.94 -43.0 92.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 122.058 0.932 . . . . 0.0 110.383 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 19.2 mmmt -66.74 -46.01 76.8 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.207 -179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -76.24 -19.23 58.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.29 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.98 -33.72 9.46 Favored Glycine 0 N--CA 1.471 1.017 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.408 ' O ' ' OG ' ' B' ' 71' ' ' SER . 1.4 pp20? -88.05 -176.48 5.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.4 . . . . 0.0 110.265 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' B' ' 70' ' ' GLU . 9.5 m -174.21 -178.97 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.365 0.602 . . . . 0.0 110.079 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -99.41 -36.96 9.41 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.34 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.3 157.43 16.61 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.501 0.667 . . . . 0.0 110.025 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -145.96 84.61 1.66 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.292 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -70.85 122.4 19.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.279 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.423 ' CG ' ' N ' ' B' ' 77' ' ' HIS . 84.2 t60 -171.33 161.6 6.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.439 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.423 ' N ' ' CG ' ' B' ' 76' ' ' HIS . 57.7 t-80 -72.12 133.3 45.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.451 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -66.97 130.98 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -70.96 133.54 46.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.559 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.567 -179.9 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.529 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 3' ' ' GLU . 49.3 m -87.09 -6.06 58.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.42 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 2' ' ' SER . 23.7 mp0 56.7 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.649 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -178.42 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.399 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -63.16 -37.74 88.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.05 0.452 . . . . 0.0 110.306 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m -61.85 133.57 55.63 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.079 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.515 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -60.08 -44.8 97.41 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.007 179.453 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 77.3 Cg_exo -48.58 -22.68 4.56 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.645 1.564 . . . . 0.0 112.169 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -73.6 -27.2 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.519 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.416 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.0 OUTLIER -82.96 -30.38 28.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.135 179.663 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mt -74.05 -52.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 121.691 0.758 . . . . 0.0 111.189 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -52.12 -21.68 3.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.397 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -67.94 -37.18 81.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.49 ' CD1' ' N ' ' A' ' 14' ' ' LEU . 6.4 mp -69.97 -38.18 76.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.118 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.91 -36.7 72.83 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.883 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.56 -27.12 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -70.48 -53.34 16.68 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.983 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.0 pt -71.43 -40.43 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.088 0.47 . . . . 0.0 110.586 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -65.3 -53.08 49.22 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.889 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' MET . . . . . 0.412 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 40.9 mtt -100.16 -65.22 0.98 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.095 0.474 . . . . 0.0 110.33 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 20' ' ' MET . 19.6 t30 79.02 43.58 0.07 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.933 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -55.41 -44.94 76.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.054 0.454 . . . . 0.0 110.491 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.3 p -150.75 67.37 0.94 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.632 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 16.7 tp10 -166.9 -137.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.536 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -148.22 -163.6 1.82 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.159 0.504 . . . . 0.0 110.354 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.473 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.0 tttm -85.91 -109.89 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.1 mt -62.25 -40.95 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -54.94 -21.35 11.44 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.539 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.18 -39.86 30.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.25 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.583 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.2 -46.1 88.59 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.571 179.171 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.583 ' N ' ' SD ' ' A' ' 30' ' ' MET . 9.8 t-20 -55.89 -47.89 76.59 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.658 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 61.8 p -65.63 -53.39 42.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.804 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.416 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 73.3 t80 -62.14 -47.29 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.689 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 30' ' ' MET . 48.2 t80 -57.51 -48.48 79.16 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.697 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' NH2' ' CD2' ' B' ' 63' ' ' TYR . 6.4 tpt180 -64.32 -30.62 71.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.797 0.332 . . . . 0.0 110.36 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.8 t -69.93 -43.02 72.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.15 -63.15 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.769 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 30.9 m -47.21 -42.15 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.678 -179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.4 m -56.13 -40.36 73.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.828 0.346 . . . . 0.0 110.242 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -71.89 -43.3 65.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.702 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 90.8 mt -62.71 -46.16 89.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.361 -179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 92.8 t -65.67 -33.1 61.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.096 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -78.9 -18.3 54.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.26 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.938 ' O ' ' O ' ' A' ' 45' ' ' GLN . 42.8 t0 -65.88 169.14 6.98 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 121.217 0.532 . . . . 0.0 109.711 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.938 ' O ' ' O ' ' A' ' 44' ' ' ASP . 14.5 pt20 -13.12 -131.64 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.698 0 CA-C-O 118.51 -0.757 . . . . 0.0 112.684 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 173.75 35.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 118.379 0.536 . . . . 0.0 110.066 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.6 m -47.32 -49.58 23.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.209 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.433 ' C ' ' N ' ' A' ' 50' ' ' ALA . 16.0 tptp -169.84 134.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -48.98 -16.04 0.12 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.421 179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.433 ' N ' ' C ' ' A' ' 48' ' ' LYS . . . -78.44 -54.82 5.76 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.489 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.42 HG22 ' N ' ' A' ' 52' ' ' VAL . 23.9 m -49.99 -39.29 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.534 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.42 ' N ' HG22 ' A' ' 51' ' ' VAL . 18.3 m -77.5 -40.27 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.171 179.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.1 -37.61 87.89 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.81 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.452 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 93.3 mttt -58.83 -42.16 88.61 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.163 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -70.63 -40.94 72.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.442 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.41 -50.37 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.427 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -57.0 -38.55 73.25 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -69.0 -38.7 79.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.735 0.303 . . . . 0.0 110.355 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.48 -24.93 14.39 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.62 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 15.2 p-10 -51.56 -28.36 13.64 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.469 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.452 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 9.1 pt-20 -63.47 -31.9 73.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.504 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.66 -60.12 2.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.505 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -39.7 60.58 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.089 0.471 . . . . 0.0 110.415 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.1 -38.82 91.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.481 -178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.3 mmtt -63.35 -33.02 74.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.319 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.58 -46.25 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.523 0.678 . . . . 0.0 110.509 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.427 ' CB ' ' HZ2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -66.83 -43.19 84.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.471 -179.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -87.3 2.63 49.64 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.035 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.08 -38.55 1.13 Allowed Glycine 0 N--CA 1.478 1.473 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.473 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 pp20? -56.69 -35.13 68.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.708 0.29 . . . . 0.0 110.273 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 70' ' ' GLU . 11.9 p -60.18 144.35 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.188 0.518 . . . . 0.0 110.308 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -164.86 37.18 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.802 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.67 -3.92 38.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.387 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.407 ' C ' ' H ' ' A' ' 76' ' ' HIS . 8.3 pt-20 -99.51 -122.0 0.15 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 52.52 13.85 0.35 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.95 0.405 . . . . 0.0 110.648 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 74' ' ' GLU . 86.3 t60 -91.29 -88.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.245 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 0.455 ' O ' ' O ' ' A' ' 78' ' ' HIS . 85.9 t60 -170.27 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.506 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . 0.455 ' O ' ' O ' ' A' ' 77' ' ' HIS . 82.5 t60 58.76 140.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.611 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -57.19 -77.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.885 0.374 . . . . 0.0 110.553 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.5 t60 . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.579 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.3 mmt . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' SER . . . . . 0.42 ' O ' ' O ' ' B' ' 3' ' ' GLU . 77.1 p -64.67 -32.9 74.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.671 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' B' ' 2' ' ' SER . 79.8 tt0 59.44 144.49 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.435 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 8.2 tp -170.86 -32.73 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.687 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -59.91 -44.58 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.325 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -62.85 130.8 46.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.171 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.514 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.86 -44.23 94.18 Favored Pre-proline 0 CA--C 1.543 0.685 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.957 179.42 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.7 Cg_exo -50.03 -21.68 6.72 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 121.703 1.602 . . . . 0.0 112.21 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.94 -42.73 94.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.922 0.391 . . . . 0.0 110.497 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.467 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.9 m-85 -60.8 -43.47 98.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.291 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.37 -43.53 97.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.262 0.553 . . . . 0.0 110.472 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -51.34 -28.39 12.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.501 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.44 -35.7 73.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.212 0.529 . . . . 0.0 110.575 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 37.9 mt -67.68 -38.33 83.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.462 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -56.49 -40.77 75.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.454 ' O ' ' N ' ' B' ' 20' ' ' MET . 55.5 tt0 -66.56 -34.86 78.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.323 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -64.0 -51.68 63.11 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.754 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.13 -40.9 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.111 0.481 . . . . 0.0 110.71 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -72.03 -52.51 16.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.773 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.454 ' N ' ' O ' ' B' ' 16' ' ' GLN . 15.3 tpp -87.05 -63.84 1.24 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.16 0.505 . . . . 0.0 110.45 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 69.85 40.77 1.26 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.92 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -53.56 -35.2 60.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.058 0.456 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -165.59 64.44 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.657 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . 0.401 ' CG ' ' H ' ' B' ' 25' ' ' ASP . 5.1 tp10 -158.6 -132.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.333 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . 0.401 ' H ' ' CG ' ' B' ' 24' ' ' GLU . 55.0 m-20 -153.05 -176.27 5.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.548 0.689 . . . . 0.0 110.081 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -80.81 -105.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.572 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.3 mm -60.33 -39.84 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -69.21 18.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.096 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.572 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.82 -49.51 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.381 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.561 ' SD ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -56.31 -38.01 70.7 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.386 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.54 ' N ' ' SD ' ' B' ' 30' ' ' MET . 58.5 t-20 -50.69 -44.11 57.83 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.321 -178.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.7 t -74.46 -54.97 6.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.719 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.467 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 88.2 t80 -59.04 -49.8 76.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.535 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.539 ' N ' ' O ' ' B' ' 30' ' ' MET . 22.7 t80 -55.31 -45.47 76.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -63.98 -33.86 76.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 34.3 t -68.56 -45.08 73.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.503 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . 0.615 ' O ' ' N ' ' B' ' 41' ' ' LEU . 88.4 t -67.95 -62.7 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.305 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.437 ' CG1' ' N ' ' B' ' 39' ' ' SER . 8.0 p -48.17 -44.39 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.607 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.437 ' N ' ' CG1' ' B' ' 38' ' ' VAL . 50.8 p -57.82 -57.9 10.73 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.054 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.3 m -73.59 -43.19 60.34 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 122.39 1.09 . . . . 0.0 111.287 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.615 ' N ' ' O ' ' B' ' 37' ' ' VAL . 41.8 tp -54.14 -41.57 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.37 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -80.46 -16.55 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -83.21 -17.09 43.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.465 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.543 ' CG ' ' H ' ' B' ' 45' ' ' GLN . 24.5 t0 -104.75 -151.87 0.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.103 0.477 . . . . 0.0 109.715 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . 0.543 ' H ' ' CG ' ' B' ' 44' ' ' ASP . 73.5 tp60 31.9 -93.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.152 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ASP . 10.3 mt 54.37 75.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.178 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -136.27 -25.54 1.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.579 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -165.06 128.78 2.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -49.48 -33.57 14.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.475 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.63 -49.98 35.03 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.021 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 t -50.58 -45.2 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.379 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.5 -35.88 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.804 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 55.3 tp -62.58 -39.79 94.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.486 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.476 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 93.9 mttt -58.41 -43.01 88.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.23 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -68.74 -40.61 79.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.2 -51.38 73.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -54.23 -39.15 66.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.212 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 32.2 m170 -67.54 -35.05 78.31 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.264 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.99 -37.65 83.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.254 -179.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -55.77 -32.71 63.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.417 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -58.96 -35.12 72.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.503 . . . . 0.0 110.453 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.62 19.03 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.85 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.615 ' CD2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -52.1 -50.14 62.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.302 0.572 . . . . 0.0 109.746 -179.537 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.4 t30 -62.44 -32.07 72.88 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.377 -178.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -60.57 -36.76 79.3 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.228 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 59.3 t -64.39 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 123.333 1.54 . . . . 0.0 110.863 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.647 ' C ' ' H ' ' B' ' 69' ' ' GLY . 7.2 mmmt -72.31 -30.67 65.0 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 113.637 -1.619 . . . . 0.0 111.496 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 49.2 ttt85 -55.02 1.06 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.608 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.647 ' H ' ' C ' ' B' ' 67' ' ' LYS . . . 97.19 18.53 28.68 Favored Glycine 0 N--CA 1.46 0.235 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.88 -26.53 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.499 0.666 . . . . 0.0 110.145 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 7.4 t -81.91 -15.34 54.25 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.561 -178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -135.45 24.56 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.532 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' B' ' 75' ' ' HIS . 58.7 tp -62.53 -70.89 0.18 Allowed 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.633 0.73 . . . . 0.0 110.084 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 76' ' ' HIS . 54.3 mt-10 63.45 -57.55 0.18 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.935 0.874 . . . . 0.0 110.789 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.522 ' N ' ' O ' ' B' ' 73' ' ' LEU . 83.4 t60 58.54 -77.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.606 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' B' ' 74' ' ' GLU . 84.1 t60 -160.48 133.58 6.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.415 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -161.09 139.93 10.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.538 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -74.68 144.44 43.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.412 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -65.09 -43.48 91.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.467 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 6.6 p80 . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 117.933 -1.032 . . . . 0.0 110.572 -179.971 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.2 p -160.21 164.02 33.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.079 0.466 . . . . 0.0 110.595 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -118.5 52.55 1.02 Allowed 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.696 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.4 -20.16 64.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.268 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -61.91 -44.32 97.03 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.119 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -72.29 135.45 45.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.315 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.578 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -68.78 -40.18 16.61 Favored Pre-proline 0 CA--C 1.539 0.549 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.578 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 78.4 Cg_exo -52.08 -27.18 28.2 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 121.731 1.62 . . . . 0.0 111.883 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -61.71 -41.76 98.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -58.15 -39.04 77.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.053 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 54.6 mt -69.8 -45.91 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-O 121.451 0.644 . . . . 0.0 110.507 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -49.11 -24.09 1.5 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.806 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -74.92 -30.04 61.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.544 0.688 . . . . 0.0 110.695 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.443 HD21 ' CG ' ' A' ' 33' ' ' TYR . 25.1 mt -70.04 -39.5 75.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.601 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -51.22 -39.21 56.08 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.258 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -67.29 -36.52 81.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.406 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.62 -51.42 68.58 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.665 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.2 pt -73.84 -43.77 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.267 0.556 . . . . 0.0 110.958 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 83.8 tt0 -65.55 -54.3 30.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.672 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.5 mtt -101.03 -160.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 109.861 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -151.82 47.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.96 -49.05 74.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.0 p -176.2 65.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.404 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 12.4 tp10 -163.06 -137.02 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.98 0.419 . . . . 0.0 110.203 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -157.79 -166.96 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 110.16 -179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -81.81 -103.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.56 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.567 ' C ' ' H ' ' A' ' 29' ' ' ALA . 4.8 tt -65.12 -36.25 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.509 -179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 83.8 t60 -65.65 11.25 0.07 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.678 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.567 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -80.36 -44.39 19.52 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.921 0.391 . . . . 0.0 110.653 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.493 ' O ' ' N ' ' A' ' 34' ' ' TYR . 12.3 ptt? -58.8 -47.9 83.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.164 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' ' CG ' ' A' ' 30' ' ' MET . 12.2 m120 -53.06 -53.91 43.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.809 -178.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.42 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 73.3 m -57.99 -51.25 70.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.512 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.443 ' CG ' HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -64.64 -25.52 67.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.124 179.274 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.493 ' N ' ' O ' ' A' ' 30' ' ' MET . 53.9 t80 -71.64 -55.43 7.76 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.054 0.454 . . . . 0.0 110.358 -178.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -65.98 -24.71 66.84 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.454 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -67.23 -51.61 51.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.69 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.45 -55.42 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.6 t -49.48 -53.32 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.662 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -50.35 -56.68 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.842 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 44' ' ' ASP . 18.9 m -61.51 -42.9 99.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.208 0.528 . . . . 0.0 110.521 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.96 -44.4 94.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.409 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 82.6 t -73.55 -40.0 54.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.027 0.442 . . . . 0.0 110.276 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -73.01 -21.39 60.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.708 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.602 ' CG ' ' H ' ' A' ' 45' ' ' GLN . 26.7 t70 -101.36 -152.07 0.43 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.097 0.475 . . . . 0.0 110.008 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.602 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 5.9 tp-100 30.42 -91.97 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.412 0.625 . . . . 0.0 111.425 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 44' ' ' ASP . 7.3 mt 56.74 101.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.041 178.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.1 t -168.29 -28.13 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.897 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.519 ' O ' HG21 ' A' ' 51' ' ' VAL . 38.1 tptt -164.15 129.38 2.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.87 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.52 -18.1 1.01 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.989 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -75.9 -57.04 4.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.869 -179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 48' ' ' LYS . 28.7 m -46.64 -36.31 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.755 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.451 ' N ' HG21 ' A' ' 51' ' ' VAL . 34.1 m -81.72 -33.76 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 178.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 39.4 tp -57.3 -55.86 29.34 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.444 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 18.9 ptmt -52.62 -42.55 64.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.317 0.58 . . . . 0.0 110.291 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.444 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 25.8 mmt85 -61.14 -40.95 95.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.753 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.1 mm -69.68 -49.57 57.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.312 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -56.02 -46.08 78.92 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.495 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -66.98 -45.32 78.0 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.245 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.405 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 38.8 tp -50.2 -24.86 3.09 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.794 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -62.93 -32.99 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.241 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -62.34 -39.55 93.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.715 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -58.29 5.71 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.571 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.461 ' OH ' ' NZ ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -54.05 -42.07 68.82 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 109.877 -179.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.418 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 59.8 t-20 -66.02 -40.87 91.44 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.588 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -61.49 -39.59 91.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.44 -179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.0 t -53.55 -59.88 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.454 -179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.461 ' NZ ' ' OH ' ' A' ' 63' ' ' TYR . 32.0 mtmt -62.45 -46.42 88.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.977 0.894 . . . . 0.0 111.437 -179.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -52.11 -15.67 0.62 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.052 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.407 ' N ' ' C ' ' A' ' 67' ' ' LYS . . . -101.16 -13.76 32.67 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' A' ' 67' ' ' LYS . 80.3 mm-40 -100.79 -101.41 0.25 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.648 0.261 . . . . 0.0 110.369 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 t 52.96 36.82 22.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.227 0.537 . . . . 0.0 110.658 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -97.98 -21.72 16.68 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.51 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 30.4 mt -95.58 0.78 53.32 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.462 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -160.26 44.44 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -64.44 -50.19 68.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.323 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.0 m80 47.23 -172.48 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.581 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -106.1 124.56 49.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.155 0.502 . . . . 0.0 110.311 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -74.21 144.43 44.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.28 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 76.3 m80 52.93 85.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.639 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.4 t60 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.473 -179.876 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mmm . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 97.1 p -159.95 158.96 31.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 tp10 -80.17 134.28 36.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.155 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 mt 51.76 -165.58 0.05 Allowed 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.619 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . 0.515 ' O ' ' CB ' ' B' ' 6' ' ' SER . 98.1 m-85 44.26 77.39 0.07 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.33 0.586 . . . . 0.0 109.997 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.3 p 152.33 77.89 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.243 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.448 ' C ' ' O ' ' B' ' 6' ' ' SER . 3.5 t -35.25 -54.67 1.12 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.076 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 19.3 Cg_endo -53.37 -22.24 20.24 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 121.366 1.377 . . . . 0.0 112.44 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 6' ' ' SER . 12.4 t80 -66.98 -44.76 79.6 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.769 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.476 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.1 m-85 -71.66 -46.42 58.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.759 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 40.1 mt -61.14 -44.83 99.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.275 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -49.8 -31.39 11.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.231 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . 0.606 HD22 ' HE2' ' B' ' 17' ' ' HIS . 5.4 t-20 -71.38 -43.44 66.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.386 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 46.2 mt -62.67 -39.09 92.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.244 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.258 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -75.2 -28.22 59.92 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.014 0.435 . . . . 0.0 110.696 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.606 ' HE2' HD22 ' B' ' 13' ' ' ASN . 34.7 m170 -65.43 -51.49 59.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' B' ' 19' ' ' GLU . 3.7 pt -73.08 -44.55 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.085 0.469 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' B' ' 18' ' ' ILE . 72.0 mm-40 -67.48 -50.43 59.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.129 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.0 tpp -94.0 -152.81 0.35 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.538 0.685 . . . . 0.0 109.98 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.97 41.92 0.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.003 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -55.25 -50.5 69.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.237 0.541 . . . . 0.0 110.491 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 36.7 p -174.62 65.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.289 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -162.86 -146.9 0.11 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.913 0.387 . . . . 0.0 110.403 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -144.44 -163.41 1.68 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.113 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -81.54 -108.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.5 mt -64.72 -42.26 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -50.16 -28.79 7.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.82 -31.67 1.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.728 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -65.82 -50.69 63.71 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.355 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' B' ' 30' ' ' MET . 10.8 t30 -57.56 -56.73 18.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.964 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 63.7 p -54.54 -45.57 73.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.476 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 76.3 t80 -70.15 -34.53 73.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.538 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' B' ' 30' ' ' MET . 25.3 t80 -61.65 -47.81 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.612 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.482 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.7 mpt_? -69.51 -26.48 64.55 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -68.68 -46.38 69.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.8 t -64.89 -66.12 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.544 -0.863 . . . . 0.0 110.835 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 25.1 m -44.6 -39.82 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.577 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 11.0 t -60.73 -44.93 96.02 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.142 179.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.7 m -69.67 -46.47 66.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 0.0 110.998 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.413 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -60.28 -33.74 72.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.46 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -87.63 -37.58 10.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -73.12 -14.97 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.672 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' B' ' 41' ' ' LEU . 33.6 t70 -143.67 160.52 40.55 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.484 0.659 . . . . 0.0 110.051 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 41.25 63.35 1.25 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.083 -179.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.87 42.11 1.68 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.56 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 9.1 t -54.92 -44.01 73.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.764 0.792 . . . . 0.0 110.455 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.419 ' O ' HG23 ' B' ' 51' ' ' VAL . 38.2 tptt -146.81 127.44 14.22 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.881 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -50.19 -15.03 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.939 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.404 ' N ' ' C ' ' B' ' 48' ' ' LYS . . . -77.08 -55.79 5.14 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.596 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . 0.446 HG23 ' H ' ' B' ' 52' ' ' VAL . 28.2 m -48.08 -38.0 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.773 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . 0.446 ' H ' HG23 ' B' ' 51' ' ' VAL . 30.1 m -78.68 -34.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.144 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.14 -42.25 90.24 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.427 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -56.29 -43.81 79.23 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.018 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.29 -45.06 93.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.93 -52.04 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.786 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -55.32 -41.39 72.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.391 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.21 -38.83 63.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.331 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 5.8 tt -52.63 -26.2 12.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.082 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -52.43 -28.59 20.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.438 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.46 -32.85 74.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.91 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.75 -62.92 1.21 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.748 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.49 -38.97 14.87 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -65.07 -38.55 91.15 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.128 0.49 . . . . 0.0 110.071 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.2 tptp -63.33 -33.07 74.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.179 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 60.6 t -62.57 -46.75 95.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.928 0.87 . . . . 0.0 110.466 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -71.52 -43.0 67.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.203 1.001 . . . . 0.0 112.011 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 29.6 mmm-85 -79.09 -14.14 59.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.478 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -95.88 -42.12 3.65 Favored Glycine 0 N--CA 1.469 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -67.14 -31.75 72.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.802 0.334 . . . . 0.0 110.329 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -71.83 150.28 44.45 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.109 0.48 . . . . 0.0 110.03 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.431 ' O ' ' C ' ' B' ' 73' ' ' LEU . 31.0 mmtp 45.02 -167.55 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.067 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.431 ' C ' ' O ' ' B' ' 72' ' ' LYS . 1.5 tt 34.35 69.99 0.14 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.976 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -67.3 -50.56 59.75 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.345 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.462 ' O ' ' CG ' ' B' ' 76' ' ' HIS . 84.8 t60 -171.83 144.47 1.78 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.481 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.462 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 58.9 m80 -157.75 108.94 2.26 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.433 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . 0.405 ' ND1' ' O ' ' B' ' 78' ' ' HIS . 60.2 t-80 -157.88 146.33 19.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.405 ' O ' ' ND1' ' B' ' 77' ' ' HIS . 75.1 m80 -70.3 137.34 50.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.379 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -70.95 156.95 39.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.483 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.887 -179.807 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 ptt? . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.7 p 50.7 97.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.401 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.574 ' C ' ' H ' ' A' ' 5' ' ' PHE . 4.6 tt0 57.03 -168.87 0.11 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.623 0.725 . . . . 0.0 110.0 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.405 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 45.4 tp 67.79 -39.93 0.4 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.56 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.574 ' H ' ' C ' ' A' ' 3' ' ' GLU . 74.3 t80 -59.61 -44.53 93.38 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m -65.54 125.48 25.34 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.22 0.533 . . . . 0.0 110.352 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.496 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -52.42 -50.25 80.97 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.143 179.07 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 58.1 Cg_exo -41.59 -27.64 0.53 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 121.845 1.697 . . . . 0.0 112.32 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -60.48 -39.43 87.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 110.205 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.422 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.8 m-85 -58.05 -47.05 84.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -66.1 -47.14 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.465 0.65 . . . . 0.0 110.62 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -50.61 -28.55 8.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.62 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -72.36 -37.78 68.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.37 0.605 . . . . 0.0 110.648 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.3 mt -67.53 -35.19 78.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.163 -179.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -52.16 -41.85 62.92 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.34 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -68.01 -36.46 80.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.834 0.35 . . . . 0.0 110.675 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.1 -49.3 78.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.721 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.422 HG13 ' N ' ' A' ' 19' ' ' GLU . 27.0 pt -73.24 -41.43 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.783 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' HG13 ' A' ' 18' ' ' ILE . 47.6 tp10 -55.06 -53.98 48.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.311 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 17.9 ptp -121.25 -134.59 0.31 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.241 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -159.88 53.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.159 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -55.7 -46.41 77.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.3 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.0 p -175.42 57.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -164.71 -139.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.285 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -147.86 -166.3 2.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.349 0.595 . . . . 0.0 110.54 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.5 -105.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.471 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.414 ' O ' ' CG ' ' A' ' 30' ' ' MET . 17.4 tt -63.96 -41.83 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.163 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -55.65 -11.58 0.97 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.592 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -49.84 -42.83 48.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.593 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.553 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.1 ptm -65.98 -54.76 22.03 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.194 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.484 ' H ' ' HG3' ' A' ' 30' ' ' MET . 19.0 t-20 -51.61 -47.83 63.48 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.495 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 36' ' ' SER . 39.9 t -68.31 -54.54 16.72 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.648 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.422 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 42.8 t80 -60.63 -48.97 79.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.642 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.553 ' N ' ' O ' ' A' ' 30' ' ' MET . 66.3 t80 -51.88 -43.27 63.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.791 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.6 ttm-85 -77.16 -26.58 53.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.419 ' OG ' ' O ' ' A' ' 32' ' ' SER . 30.0 m -64.79 -46.83 80.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.771 -179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 26.6 m -76.23 -44.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.526 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.424 ' CG2' ' O ' ' A' ' 34' ' ' TYR . 24.6 t -46.61 -43.33 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.207 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.0 p -58.61 -35.09 71.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.029 0.443 . . . . 0.0 110.506 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 44' ' ' ASP . 95.6 m -85.82 -45.22 11.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.723 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.477 ' C ' ' H ' ' A' ' 43' ' ' GLN . 4.4 mm? -63.21 -45.73 90.31 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.039 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.8 p -68.67 3.99 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.294 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.477 ' H ' ' C ' ' A' ' 41' ' ' LEU . 57.1 tt0 -129.28 -23.34 2.98 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.255 -179.474 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 40' ' ' THR . 23.4 t0 -57.79 121.88 11.54 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.25 0.548 . . . . 0.0 110.035 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.452 ' C ' ' O ' ' A' ' 44' ' ' ASP . 11.2 pt20 31.58 89.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.281 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.23 45.71 0.47 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.393 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -59.17 -31.37 68.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.388 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -165.79 131.21 2.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.228 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -50.04 -32.1 14.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.404 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.49 ' N ' HD21 ' B' ' 49' ' ' ASN . . . -72.42 -48.72 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.386 0.612 . . . . 0.0 110.601 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.1 t -49.13 -42.42 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.751 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 25.6 m -75.44 -36.36 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.209 0.528 . . . . 0.0 110.295 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -35.82 82.19 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.471 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 59.3 mttp -53.26 -41.98 66.04 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.301 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -65.26 -36.66 84.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.321 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 41.2 mm -66.84 -51.67 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.738 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 77.6 mt-30 -55.37 -40.26 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.348 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.471 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 38.1 m80 -75.73 -40.05 56.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.546 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 62.2 tp -51.51 -30.89 21.87 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.742 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 11.6 p-10 -52.88 -28.4 22.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.38 0.609 . . . . 0.0 110.624 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.549 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.7 pt-20 -57.93 -36.66 72.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.366 -179.448 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.6 -53.82 12.47 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.4 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.441 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.95 -41.36 33.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.208 -179.842 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.441 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 39.5 m-80 -68.09 -41.64 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -65.53 -34.81 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.433 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -60.78 -62.31 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.513 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.412 ' C ' ' H ' ' A' ' 69' ' ' GLY . 26.7 mtmt -60.71 -51.86 67.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.349 -0.54 . . . . 0.0 111.148 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 -55.43 -11.86 0.95 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.179 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 67' ' ' LYS . . . -101.83 -28.41 6.62 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -53.77 -100.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.693 0.282 . . . . 0.0 110.638 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -164.83 -131.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.342 0.591 . . . . 0.0 110.215 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -65.8 -130.96 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.355 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.1 mp 44.85 58.77 3.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.686 -179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.418 ' O ' ' O ' ' A' ' 75' ' ' HIS . 6.3 pt-20 -148.82 -36.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.653 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.418 ' O ' ' O ' ' A' ' 74' ' ' GLU . 0.9 OUTLIER 59.62 146.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.982 0.42 . . . . 0.0 110.363 -179.759 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -115.62 45.36 1.7 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -110.83 110.03 20.47 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.206 0.527 . . . . 0.0 110.397 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -157.44 156.47 32.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.556 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -68.01 130.35 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.582 -179.962 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 34.9 t -64.91 -26.37 68.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.4 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -74.0 139.07 44.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.688 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.21 9.47 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.392 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -59.9 -44.36 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.014 0.435 . . . . 0.0 110.33 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.48 131.73 50.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.302 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.687 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 25.3 t -58.81 -48.58 96.56 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.257 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.687 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 7.4 Cg_endo -47.5 -25.76 5.55 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.969 1.779 . . . . 0.0 112.077 -179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.45 -41.23 98.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.217 0.532 . . . . 0.0 110.449 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.452 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.5 m-85 -59.36 -40.65 87.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.253 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.3 mt -70.04 -43.47 79.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.306 0.574 . . . . 0.0 110.501 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -50.63 -28.78 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.542 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -73.25 -33.28 65.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.034 0.445 . . . . 0.0 110.483 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 25.7 mt -72.0 -38.95 69.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.545 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -56.74 -38.61 72.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.191 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.462 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.7 tt0 -66.98 -35.81 80.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.533 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -63.22 -51.86 64.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.949 0.404 . . . . 0.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . 0.413 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.8 pt -72.53 -44.42 61.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.787 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . 0.413 ' N ' HG13 ' B' ' 18' ' ' ILE . 83.2 tt0 -68.85 -53.98 18.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.462 ' N ' ' O ' ' B' ' 16' ' ' GLN . 11.2 tpp -86.75 -153.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.196 0.522 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -162.27 36.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.515 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -46.06 -63.16 1.05 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.995 0.426 . . . . 0.0 110.637 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -172.41 65.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.48 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 19.1 tp10 -154.92 -131.33 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.025 0.44 . . . . 0.0 110.359 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -160.37 -173.86 4.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.343 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . 0.462 ' NZ ' ' OE2' ' B' ' 74' ' ' GLU . 85.9 tttt -74.35 -106.36 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.604 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.605 ' C ' ' H ' ' B' ' 29' ' ' ALA . 19.0 mt -66.0 -33.49 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -64.01 8.67 0.09 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.859 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.605 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.46 -43.56 31.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.742 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.417 ' CG ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -58.82 -46.86 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.058 -179.749 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -51.99 -48.75 64.27 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.393 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 65.7 p -67.78 -55.68 12.13 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.907 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.452 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 86.2 t80 -56.78 -47.49 80.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.596 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.412 ' N ' ' O ' ' B' ' 30' ' ' MET . 36.7 t80 -58.16 -44.2 87.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.936 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -61.97 -35.46 78.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.281 0.563 . . . . 0.0 110.788 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.2 p -73.92 -44.25 55.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.66 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 50.0 t -69.96 -57.1 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.619 -179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.464 ' CG1' ' N ' ' B' ' 39' ' ' SER . 5.8 p -48.61 -41.52 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.033 0.444 . . . . 0.0 110.396 -179.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.464 ' N ' ' CG1' ' B' ' 38' ' ' VAL . 42.6 t -64.67 -38.17 90.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.265 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 44' ' ' ASP . 89.0 m -71.95 -44.06 64.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.385 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.66 -44.04 80.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -73.37 -32.4 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -77.65 -35.11 52.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.218 0.532 . . . . 0.0 110.61 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 40' ' ' THR . 98.8 m-20 -39.12 -68.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -174.53 139.67 0.58 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 mp -96.04 48.32 1.11 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.341 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -61.56 -36.01 79.4 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.004 0.43 . . . . 0.0 110.6 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.452 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -166.61 128.48 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.62 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 24.4 p30 -47.91 -34.65 9.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.572 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.511 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -65.79 -49.59 67.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.007 0.432 . . . . 0.0 110.813 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.4 t -50.96 -43.98 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.71 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.2 m -80.68 -37.28 16.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.119 0.485 . . . . 0.0 110.65 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.15 -47.34 83.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.938 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.608 ' HZ2' ' NE ' ' B' ' 55' ' ' ARG . 16.7 pttp -54.16 -41.29 68.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.579 0.704 . . . . 0.0 110.27 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . 0.608 ' NE ' ' HZ2' ' B' ' 54' ' ' LYS . 27.2 mmt180 -65.35 -37.91 88.48 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.136 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 6.0 mm -66.17 -48.56 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.684 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -56.18 -41.86 76.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.405 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -69.17 -38.9 78.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.384 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.83 -36.32 62.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.572 -178.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -53.82 -27.43 29.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.438 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -64.51 -37.95 89.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.452 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.6 -53.65 10.0 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.404 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -51.34 -39.63 57.43 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.056 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . 0.453 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 49.7 t30 -71.02 -38.17 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.251 -178.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 43.0 mmtt -59.66 -32.13 70.19 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.438 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.7 t -64.67 -60.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.46 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -67.83 -45.13 75.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.372 0.606 . . . . 0.0 110.985 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -54.55 -23.21 15.68 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.313 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.89 -7.63 70.55 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -101.73 174.84 5.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.29 0.567 . . . . 0.0 110.37 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 37.1 t -161.9 -178.89 6.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.333 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -86.86 -44.12 11.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.469 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.461 ' N ' ' CD2' ' B' ' 73' ' ' LEU . 4.2 mm? -56.69 -50.35 72.39 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.838 -178.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.462 ' OE2' ' NZ ' ' B' ' 26' ' ' LYS . 96.9 mt-10 54.08 57.42 5.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.541 179.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.517 ' CG ' ' N ' ' B' ' 76' ' ' HIS . 82.7 t60 -62.3 169.11 3.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.396 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.517 ' N ' ' CG ' ' B' ' 75' ' ' HIS . 99.4 m-70 -75.37 64.2 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.495 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 51.0 m170 52.27 -168.51 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -152.24 54.65 0.81 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.545 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.6 p80 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.532 179.916 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.4 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.8 t -166.5 -76.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.512 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 51.12 79.11 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.365 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 tt -158.42 102.93 1.76 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.13 0.49 . . . . 0.0 110.322 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.47 67.28 2.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.178 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.49 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 29.8 t 51.73 -160.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.935 0.398 . . . . 0.0 110.578 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.529 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.6 t -51.71 -55.63 28.23 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.6 178.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.529 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 28.1 Cg_exo -36.12 -26.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.353 2.035 . . . . 0.0 112.479 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 7' ' ' VAL . 88.4 t80 -60.7 -43.11 98.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.394 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -56.46 -47.99 78.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.55 -45.09 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.415 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -51.65 -25.19 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.672 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.32 -36.4 74.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 110.48 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 14' ' ' LEU . 8.3 mp -68.41 -37.75 80.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.33 -39.35 86.77 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.259 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -55.23 -26.6 40.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.619 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -73.74 -53.74 9.66 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.849 -179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -71.54 -42.89 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.493 0.664 . . . . 0.0 110.878 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.439 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 79.4 mm-40 -62.17 -53.03 61.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.179 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.3 mtt -103.05 -141.07 0.36 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.088 0.471 . . . . 0.0 110.081 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -169.84 56.5 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -51.61 63.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.193 0.52 . . . . 0.0 110.613 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 t 179.38 73.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.211 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.447 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 6.3 tp10 -164.6 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.995 0.426 . . . . 0.0 110.397 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -149.66 -172.18 4.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.46 0.648 . . . . 0.0 110.213 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -79.75 -108.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.615 ' O ' ' SD ' ' A' ' 30' ' ' MET . 20.0 tt -61.52 -37.52 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -69.56 20.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.067 0.46 . . . . 0.0 111.018 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.581 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -73.9 -45.91 47.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.615 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -59.66 -38.97 82.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.376 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.56 ' N ' ' SD ' ' A' ' 30' ' ' MET . 18.5 m120 -51.4 -44.96 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.272 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.447 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 6.8 t -73.32 -54.5 8.21 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.813 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 64.7 t80 -59.62 -50.66 73.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.542 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.573 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.1 t80 -54.9 -40.8 70.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.818 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.3 ttt-85 -72.33 -27.15 62.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.848 0.356 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -70.59 -44.37 67.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.404 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.57 ' O ' ' N ' ' A' ' 41' ' ' LEU . 59.3 t -66.09 -63.82 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.791 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.212 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.407 ' CG2' ' N ' ' A' ' 39' ' ' SER . 26.3 m -47.18 -43.7 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.965 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.407 ' N ' ' CG2' ' A' ' 38' ' ' VAL . 11.5 t -53.27 -59.1 4.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 m -77.73 -41.55 37.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.993 0.902 . . . . 0.0 111.277 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.57 ' N ' ' O ' ' A' ' 37' ' ' VAL . 40.7 tp -55.17 -41.34 71.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.417 ' O ' ' CG1' ' A' ' 42' ' ' VAL . 55.0 t -68.25 -3.85 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 120.912 0.387 . . . . 0.0 110.173 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.555 ' O ' ' C ' ' A' ' 44' ' ' ASP . 11.3 tp-100 -113.07 -29.56 7.28 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.035 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.555 ' C ' ' O ' ' A' ' 43' ' ' GLN . 46.7 t0 -17.81 -78.92 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.188 0.518 . . . . 0.0 111.341 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.421 ' O ' ' C ' ' A' ' 46' ' ' LEU . 27.5 pt20 -142.89 0.5 1.23 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.554 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' A' ' 45' ' ' GLN . 5.5 tp 34.18 50.39 0.36 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.099 0.476 . . . . 0.0 110.722 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -56.21 -28.49 58.51 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.606 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.473 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 62.2 tttp -178.66 143.92 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.324 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -57.71 -38.82 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.694 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.473 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -68.44 -49.88 56.69 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.75 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 t -51.15 -65.08 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.08 -31.95 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.275 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.52 -42.52 98.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.101 0.476 . . . . 0.0 110.402 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -59.99 -40.28 88.61 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.134 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -66.63 -39.45 88.29 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.317 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.25 -48.88 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.66 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -57.15 -33.02 66.98 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.134 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 4.6 t-80 -74.54 -40.49 61.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.027 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.2 -29.24 63.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.067 0.46 . . . . 0.0 110.532 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -51.38 -30.65 19.63 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.75 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 7.5 pt-20 -60.72 -28.97 69.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.21 -59.67 2.74 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.368 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -42.98 66.71 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.348 0.594 . . . . 0.0 110.218 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -62.69 -39.02 92.66 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.2 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -63.6 -38.53 91.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.502 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.04 -50.89 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-O 121.336 0.588 . . . . 0.0 110.355 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.88 -47.31 78.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.689 0.757 . . . . 0.0 111.304 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -56.16 -18.38 9.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.071 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.44 -18.41 52.62 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -81.05 -100.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 77.7 p -73.28 98.34 2.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.012 0.434 . . . . 0.0 110.635 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -68.32 -106.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.34 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -89.11 63.03 6.47 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.373 0.606 . . . . 0.0 110.479 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.36 -3.43 0.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.067 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.492 ' H ' ' C ' ' A' ' 73' ' ' LEU . 64.7 t-80 -67.34 154.4 41.42 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.551 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . 0.436 ' N ' ' ND1' ' A' ' 75' ' ' HIS . 46.1 t-80 -158.87 -44.52 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.579 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -162.59 -42.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.607 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.9 t60 54.19 99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.579 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -57.73 124.3 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.416 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.505 179.893 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.536 ' SD ' ' N ' ' B' ' 1' ' ' MET . 2.2 mpt? . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 38.6 m -67.14 142.53 57.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.331 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -113.84 47.81 1.14 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.633 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . 0.536 ' O ' ' N ' ' B' ' 6' ' ' SER . 3.6 mm? 50.98 -104.29 0.16 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.641 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 53.9 t80 63.28 -67.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.149 0.5 . . . . 0.0 110.45 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' SER . . . . . 0.536 ' N ' ' O ' ' B' ' 4' ' ' LEU . 1.3 m -60.6 113.75 2.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.482 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.623 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 67.1 t -55.37 -49.86 90.07 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.826 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.623 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 6.7 Cg_endo -46.7 -20.6 1.1 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.831 1.687 . . . . 0.0 112.296 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -60.17 -42.54 95.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.151 0.501 . . . . 0.0 110.489 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . 0.461 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.5 m-85 -58.52 -41.97 86.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.407 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 64.6 mt -67.65 -44.23 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 121.533 0.682 . . . . 0.0 110.464 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -51.61 -30.61 21.84 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.629 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.53 -32.05 70.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.115 0.483 . . . . 0.0 110.408 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.67 -39.35 70.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.293 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -55.85 -32.1 63.33 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.095 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -69.25 -30.61 68.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.522 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -67.87 -50.54 55.86 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 pt -72.73 -35.86 51.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 110.773 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -70.94 -54.34 11.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.43 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 28.8 ttp -99.03 -62.5 1.23 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.417 ' CB ' ' O ' ' B' ' 20' ' ' MET . 11.1 t-20 78.6 49.81 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.244 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -51.06 -41.34 59.85 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 110.844 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -165.44 65.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.235 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -154.43 -131.97 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.179 0.514 . . . . 0.0 110.405 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 69.1 m-20 -151.93 -175.59 5.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.46 0.648 . . . . 0.0 109.996 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -80.02 -104.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.95 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.42 ' C ' ' H ' ' B' ' 29' ' ' ALA . 15.8 tt -63.11 -37.12 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.243 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -63.13 -3.52 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.477 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.42 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.54 -46.52 83.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.407 179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -63.96 -43.17 96.59 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.176 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.574 ' N ' ' SD ' ' B' ' 30' ' ' MET . 22.5 t-20 -52.48 -53.65 42.91 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.769 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 8.3 t -64.22 -53.51 48.11 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.823 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.461 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -59.22 -49.44 77.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.514 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.3 t80 -56.92 -47.24 81.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.821 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -65.06 -31.35 72.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.507 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.4 t -68.8 -42.85 76.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.646 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.11 -63.68 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.764 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.409 ' CG2' ' N ' ' B' ' 39' ' ' SER . 26.7 m -48.83 -44.46 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.41 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' SER . . . . . 0.467 ' HG ' ' N ' ' B' ' 40' ' ' THR . 62.9 p -60.7 -40.23 91.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.412 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.467 ' N ' ' HG ' ' B' ' 39' ' ' SER . 96.7 m -69.4 -46.76 66.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.121 0.486 . . . . 0.0 110.677 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' B' ' 44' ' ' ASP . 93.3 mt -60.35 -30.06 69.3 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.409 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -89.16 -39.69 12.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.154 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -69.38 -13.66 62.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' B' ' 45' ' ' GLN . 71.8 m-20 -146.45 166.74 25.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.346 0.593 . . . . 0.0 109.564 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 15.5 tt0 79.22 -77.99 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.71 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 24.6 mt 41.11 37.88 0.64 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.017 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.1 t -72.34 -32.22 66.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -170.41 132.2 0.98 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.611 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.23 -40.67 59.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.786 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.9 -44.49 95.97 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.46 -44.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.569 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -79.22 -44.96 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.246 0.546 . . . . 0.0 110.683 179.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.4 tp -57.06 -57.02 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.823 -178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 0.2 OUTLIER -50.9 -34.59 29.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.257 0.551 . . . . 0.0 110.502 -179.309 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt85 -71.81 -41.87 67.74 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.978 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.3 -53.42 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.523 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -58.19 -37.8 75.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.473 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 4.4 m-70 -73.41 -38.95 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.38 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 40.7 tp -55.64 -30.11 60.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.567 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -52.33 -28.28 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -59.62 -32.27 70.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.571 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -55.61 7.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.521 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -42.67 62.32 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.265 0.555 . . . . 0.0 110.397 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -63.92 -39.65 94.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.415 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.84 -38.25 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.468 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.8 t -62.14 -47.93 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.446 ' O ' ' N ' ' B' ' 70' ' ' GLU . 0.0 OUTLIER -66.04 -40.79 91.26 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 122.014 0.911 . . . . 0.0 111.296 -179.278 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -49.8 -25.79 3.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.312 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.84 -20.38 55.93 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.446 ' N ' ' O ' ' B' ' 67' ' ' LYS . 55.4 mm-40 -91.22 -139.63 0.16 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 0.0 110.057 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -62.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.488 0.661 . . . . 0.0 110.562 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.418 ' N ' ' O ' ' B' ' 70' ' ' GLU . 67.6 mttm 61.87 29.89 18.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.486 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.405 ' O ' ' C ' ' B' ' 74' ' ' GLU . 4.1 mm? -84.77 -50.39 7.63 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.967 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' B' ' 73' ' ' LEU . 27.2 mt-10 -34.65 -49.41 0.41 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.797 0.808 . . . . 0.0 110.903 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.601 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 51.1 t60 -126.42 -118.89 0.26 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.801 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.601 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 58.4 t-80 -158.93 -50.75 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.428 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 67.2 m80 52.01 84.36 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.519 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . 0.443 ' O ' ' CG ' ' B' ' 79' ' ' HIS . 80.6 m80 -56.27 -78.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.474 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' B' ' 78' ' ' HIS . 96.8 m-70 -155.3 157.25 36.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.593 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.356 179.929 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.484 ' H3 ' ' H ' ' A' ' 2' ' ' SER . 67.6 mtt . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.484 ' H ' ' H3 ' ' A' ' 1' ' ' MET . 36.5 t 51.53 55.55 9.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.618 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -65.86 -166.46 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.62 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tt -163.38 99.97 0.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.132 0.491 . . . . 0.0 110.578 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -102.07 83.51 2.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.346 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.9 p 43.68 -161.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.64 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.604 ' CG1' ' HE2' ' A' ' 58' ' ' HIS . 2.6 t -53.69 -55.21 37.77 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.043 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 77.6 Cg_exo -34.94 -25.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.391 2.06 . . . . 0.0 112.933 -179.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.569 ' N ' ' O ' ' A' ' 7' ' ' VAL . 82.9 t80 -56.37 -40.16 74.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.457 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.2 m-85 -61.82 -45.66 92.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.563 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.11 -43.68 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.427 0.632 . . . . 0.0 110.552 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -48.63 -23.74 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.397 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -74.18 -35.33 63.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.172 0.511 . . . . 0.0 110.632 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.1 mt -68.28 -39.41 82.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.574 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -57.88 -40.09 79.43 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.595 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -65.95 -31.04 71.72 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -67.15 -52.39 42.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.093 0.473 . . . . 0.0 110.97 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.8 pt -72.82 -42.86 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.576 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.1 tp10 -62.07 -54.41 41.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.432 -179.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 44.1 mtt -99.34 -139.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -170.3 49.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.232 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' OG ' ' A' ' 23' ' ' SER . 65.3 tt0 -58.12 -45.52 87.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.494 -179.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 22' ' ' GLN . 2.3 m 174.5 72.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.325 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.76 -136.77 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.115 0.483 . . . . 0.0 110.301 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -145.18 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.307 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.455 ' HZ2' ' CD ' ' A' ' 70' ' ' GLU . 63.7 tttm -96.18 -108.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.357 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.599 ' O ' ' SD ' ' A' ' 30' ' ' MET . 10.3 tp -55.85 -36.75 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.01 0.433 . . . . 0.0 110.52 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -81.42 20.51 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.526 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.72 -52.8 26.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.49 . . . . 0.0 110.754 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.599 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.88 -32.92 72.34 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.249 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.517 ' N ' ' SD ' ' A' ' 30' ' ' MET . 51.3 t30 -51.68 -48.79 63.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.472 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.6 t -67.9 -52.88 31.27 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.744 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.457 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 67.5 t80 -60.67 -48.06 83.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.325 0.583 . . . . 0.0 110.936 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.498 ' N ' ' O ' ' A' ' 30' ' ' MET . 54.4 t80 -55.18 -54.81 38.64 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.997 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.34 -35.63 76.1 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.438 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.408 ' O ' ' OG1' ' A' ' 40' ' ' THR . 37.5 t -63.04 -44.64 95.33 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.392 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.83 -56.6 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.5 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 90.5 t -54.79 -49.09 71.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.36 -178.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -60.34 -45.22 94.21 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.307 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.408 ' OG1' ' O ' ' A' ' 36' ' ' SER . 78.3 m -61.13 -48.78 80.03 Favored 'General case' 0 C--N 1.328 -0.37 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.544 -179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.86 -41.27 91.87 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.15 0.5 . . . . 0.0 110.743 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.598 ' CG1' HE22 ' B' ' 57' ' ' GLN . 60.2 t -86.16 26.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.23 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -162.32 10.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -151.15 17.98 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.186 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -147.79 -79.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.669 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.9 mt 48.46 45.75 20.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.856 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -85.61 -27.15 25.64 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.465 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 tptm -173.02 132.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.975 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.44 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 8.5 m120 -51.19 -45.79 61.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.513 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.6 -46.79 88.92 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.968 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.4 t -56.32 -46.3 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.084 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.503 ' O ' HG12 ' A' ' 56' ' ' ILE . 34.3 m -78.48 -49.92 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-O 121.736 0.779 . . . . 0.0 110.333 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.44 ' CB ' ' O ' ' A' ' 49' ' ' ASN . 9.0 tt -52.77 -59.97 3.83 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.937 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -49.22 -34.77 15.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.342 0.592 . . . . 0.0 110.196 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.2 -38.77 91.5 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.962 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.503 HG12 ' O ' ' A' ' 52' ' ' VAL . 16.3 mm -65.52 -51.03 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.449 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -58.85 -40.7 85.06 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.506 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.604 ' HE2' ' CG1' ' A' ' 7' ' ' VAL . 0.2 OUTLIER -72.62 -47.63 46.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.144 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.4 ' N ' ' ND1' ' A' ' 58' ' ' HIS . 37.6 tp -55.89 -33.69 64.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -56.76 -34.7 67.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.151 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.509 ' O ' ' ND2' ' A' ' 64' ' ' ASN . 4.7 pt-20 -52.84 -30.49 33.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.335 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.82 -42.0 35.22 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.553 0.692 . . . . 0.0 110.909 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.1 OUTLIER -56.17 -47.49 78.15 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.163 -179.471 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.517 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 0.7 OUTLIER -73.4 -22.59 60.21 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.003 0.43 . . . . 0.0 110.199 -179.246 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.22 -47.53 70.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.619 0.723 . . . . 0.0 111.348 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.429 ' CG1' ' N ' ' A' ' 67' ' ' LYS . 0.8 OUTLIER -56.77 -40.79 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.12 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.429 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 21.1 mtmt -67.86 -45.89 73.27 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.015 0.912 . . . . 0.0 111.127 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.66 -32.24 63.06 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.963 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.83 -14.28 79.9 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.455 ' CD ' ' HZ2' ' A' ' 26' ' ' LYS . 5.9 mm-40 -97.83 -168.94 1.75 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.42 179.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.6 p -163.84 127.64 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.543 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -155.5 108.39 2.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.462 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -69.44 70.11 0.26 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.723 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -58.94 -101.03 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.64 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -163.44 149.13 11.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.568 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 52.66 98.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.626 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -65.61 138.13 57.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.572 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -60.02 -49.04 79.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.511 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -168.9 130.71 1.23 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.373 179.939 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mtt . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' SER . . . . . 0.437 ' O ' ' O ' ' B' ' 3' ' ' GLU . 15.4 p -165.48 -24.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.559 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' GLU . . . . . 0.492 ' C ' ' H ' ' B' ' 5' ' ' PHE . 80.6 mm-40 56.52 158.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.489 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 57.2 mt 56.76 6.89 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.633 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' PHE . . . . . 0.492 ' H ' ' C ' ' B' ' 3' ' ' GLU . 54.1 p90 -70.06 -34.45 73.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.344 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -78.35 132.32 37.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.312 0.577 . . . . 0.0 109.793 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.589 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.2 t -67.01 -39.86 24.95 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.135 178.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.589 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 76.7 Cg_exo -50.42 -26.75 16.82 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.89 1.727 . . . . 0.0 112.154 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.6 -40.76 92.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.426 0.631 . . . . 0.0 110.517 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.76 -41.78 87.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.487 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 56.2 mt -67.44 -44.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 CA-C-O 121.292 0.568 . . . . 0.0 110.267 -179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -49.18 -27.67 3.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.59 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 61.6 t-20 -74.23 -35.11 63.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 40.7 mt -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.593 -179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -57.29 -40.17 77.22 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.09 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -65.8 -35.91 82.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.282 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . 0.439 ' O ' ' OD1' ' B' ' 21' ' ' ASN . 7.5 m-70 -65.96 -48.74 70.32 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.561 -0.455 . . . . 0.0 110.742 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -74.77 -33.12 30.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.0 110.694 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.19 -56.61 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.073 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' MET . . . . . 0.436 ' C ' ' ND2' ' B' ' 21' ' ' ASN . 47.6 mtt -87.28 -56.27 3.44 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.998 0.428 . . . . 0.0 110.617 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' B' ' 17' ' ' HIS . 3.7 m-80 73.58 46.19 0.22 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.026 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -39.95 -64.54 0.48 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.127 0.489 . . . . 0.0 111.02 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -140.62 3.44 1.88 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.768 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 20.9 tp10 -86.99 -131.85 0.06 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.125 0.488 . . . . 0.0 110.335 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -156.43 -158.13 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.336 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -95.47 -101.87 0.16 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.514 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' ILE . . . . . 0.422 HG23 HD12 ' B' ' 27' ' ' ILE . 44.3 mm -62.64 -37.26 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.43 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -69.89 2.55 3.34 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.536 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.74 -50.36 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.038 0.447 . . . . 0.0 111.087 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' MET . . . . . 0.562 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.11 -42.61 99.4 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.995 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . 0.562 ' N ' ' SD ' ' B' ' 30' ' ' MET . 44.9 t30 -50.6 -51.52 47.76 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.523 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 70.3 p -63.63 -51.56 64.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.591 179.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 43.2 t80 -65.09 -20.4 66.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' TYR . . . . . 0.562 ' N ' ' O ' ' B' ' 30' ' ' MET . 52.9 t80 -72.97 -53.87 10.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.062 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' CZ ' ' A' ' 34' ' ' TYR . 19.7 mmm180 -72.51 -18.32 61.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.821 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.0 t -68.92 -51.64 37.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.947 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' VAL . . . . . 0.442 ' CG2' ' N ' ' B' ' 38' ' ' VAL . 10.2 m -77.4 -44.72 30.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . 0.442 ' N ' ' CG2' ' B' ' 37' ' ' VAL . 71.0 t -53.71 -49.45 57.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.382 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 36.8 t -64.44 -25.74 68.14 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.864 0.364 . . . . 0.0 110.348 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' THR . . . . . 0.546 ' O ' ' N ' ' B' ' 44' ' ' ASP . 35.5 m -83.13 -50.52 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.554 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 96.8 mt -63.02 -42.24 99.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.921 0.391 . . . . 0.0 110.827 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.5 t -68.47 -17.7 22.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.415 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -108.0 -19.25 13.57 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.048 0.451 . . . . 0.0 110.794 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' B' ' 40' ' ' THR . 37.6 t70 -90.5 -25.54 20.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.394 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -117.62 160.56 21.08 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.308 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -168.74 31.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.9 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 69.1 m -67.09 -41.19 86.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 110.902 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -174.08 142.93 0.88 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.265 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -51.49 -34.85 37.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.741 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . 0.444 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -75.51 -50.97 14.08 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.858 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -50.67 -43.23 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.698 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 23.0 m -75.15 -38.01 41.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.07 0.462 . . . . 0.0 110.285 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 65.7 tp -57.97 -36.27 72.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.573 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' LYS . . . . . 0.417 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 57.6 mtpt -57.33 -41.57 80.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.549 -179.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 67.6 mtp180 -65.63 -41.36 92.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.117 0.484 . . . . 0.0 110.449 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 21.9 mm -65.33 -50.5 72.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.856 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' GLN . . . . . 0.598 HE22 ' CG1' ' A' ' 42' ' ' VAL . 92.4 mm-40 -57.53 -39.42 76.56 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.311 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 52.8 m170 -65.85 -44.97 83.86 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.161 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.7 tp -53.57 -27.78 28.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.099 0.476 . . . . 0.0 111.016 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -52.52 -36.7 55.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.94 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.78 -31.66 71.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.477 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.98 -58.88 4.09 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.124 0.488 . . . . 0.0 110.813 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -40.19 61.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.353 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -66.66 -39.06 88.03 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.595 0.712 . . . . 0.0 110.319 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.7 mmtp -62.67 -36.8 84.06 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.305 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.4 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 82.2 t -63.8 -42.15 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-O 121.378 0.608 . . . . 0.0 110.264 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -67.18 -45.12 77.92 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.693 0.759 . . . . 0.0 111.488 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 51.7 ttt85 -88.71 1.49 55.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.103 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -108.67 -34.37 2.65 Favored Glycine 0 N--CA 1.474 1.226 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' B' ' 71' ' ' SER . 1.5 pp20? -66.93 -55.41 14.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.549 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' SER . . . . . 0.503 ' H ' ' HG3' ' B' ' 70' ' ' GLU . 93.0 p 43.09 -165.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.621 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -146.51 -17.64 0.43 Allowed 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.427 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 4.3 tt -84.36 127.35 33.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.219 0.533 . . . . 0.0 110.529 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -118.01 -114.49 0.33 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.553 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' HIS . . . . . 0.61 ' HE2' ' NE2' ' B' ' 76' ' ' HIS . 79.4 t60 -155.49 -109.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.404 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' HIS . . . . . 0.61 ' NE2' ' HE2' ' B' ' 75' ' ' HIS . 6.2 m-70 -85.46 142.68 29.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.154 0.502 . . . . 0.0 110.406 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -59.38 -77.47 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.453 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 53.05 177.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.551 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -64.25 -45.46 88.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 14.9 p80 . . . . . 0 C--O 1.222 -0.393 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.451 -179.978 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -67.52 -41.63 32.46 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.943 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 59.1 Cg_exo -49.58 -24.84 9.96 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 C-N-CA 121.727 1.618 . . . . 0.0 111.915 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.59 -40.92 89.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.022 0.439 . . . . 0.0 110.362 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.6 m-85 -59.31 -42.38 91.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.232 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -65.88 -43.93 92.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.025 0.441 . . . . 0.0 110.421 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -50.84 -29.74 12.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.55 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -69.87 -35.73 74.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 110.57 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.431 HD21 ' CD1' ' A' ' 33' ' ' TYR . 42.2 mt -67.36 -38.53 84.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.693 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -55.91 -36.22 67.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -69.4 -36.69 76.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.5 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -60.88 -50.86 71.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 19' ' ' GLU . 14.1 pt -72.07 -43.65 66.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.155 0.502 . . . . 0.0 110.942 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 18' ' ' ILE . 50.5 tp10 -66.53 -51.74 53.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.391 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.1 mtt -104.51 -157.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 0.0 109.856 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' SER . 61.4 t30 -142.77 62.58 1.4 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.455 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 23' ' ' SER . 39.9 tp60 -73.01 39.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.528 0.68 . . . . 0.0 110.87 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' ASN . 5.0 p 75.76 50.86 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.402 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 12.6 tp10 -143.62 -137.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.718 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -151.78 -164.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.373 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -84.25 -105.42 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.467 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.435 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.3 mt -62.21 -41.79 92.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -57.61 -6.03 0.44 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.457 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -61.2 -45.12 95.89 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.185 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.6 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -63.42 -45.46 90.85 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.216 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.587 ' N ' ' SD ' ' A' ' 30' ' ' MET . 55.4 t30 -53.47 -49.72 66.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.047 -0.661 . . . . 0.0 110.65 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 77.0 p -63.33 -50.39 70.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.03 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.431 ' CD1' HD21 ' A' ' 14' ' ' LEU . 48.2 t80 -69.33 -22.07 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.746 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 30' ' ' MET . 40.2 t80 -74.81 -56.65 4.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.304 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -60.22 -25.25 65.48 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 120.984 0.421 . . . . 0.0 110.325 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.8 t -72.31 -45.99 57.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.865 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -66.68 -63.03 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.494 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.486 HG23 ' N ' ' A' ' 39' ' ' SER . 20.0 m -46.33 -40.49 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.523 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.486 ' N ' HG23 ' A' ' 38' ' ' VAL . 37.6 m -59.2 -39.64 83.29 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.2 m -74.42 -44.56 51.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.572 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.446 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 91.0 mt -56.51 -22.93 36.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.604 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.8 t -92.32 -28.34 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.594 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -90.37 -38.33 13.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.39 0.614 . . . . 0.0 110.813 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.451 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 26.2 p-10 -42.55 -59.4 1.9 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.986 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.438 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 13.3 pt20 -167.76 124.21 1.1 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.557 0.694 . . . . 0.0 110.395 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mp -94.7 51.72 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.378 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t -60.37 -31.33 70.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.221 0.534 . . . . 0.0 110.374 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -169.65 128.1 0.94 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.0 p30 -49.31 -33.3 12.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.179 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -71.93 -49.37 38.23 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.785 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.1 t -46.9 -38.68 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.37 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.21 -34.56 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.267 0.556 . . . . 0.0 111.099 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.457 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.82 -46.46 87.84 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.026 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -40.44 94.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.008 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.445 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 75.3 mtp180 -65.98 -39.79 90.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.283 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 86.6 mt -66.27 -46.24 87.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -58.1 -34.95 70.74 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -69.82 -42.21 73.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.16 -29.49 45.71 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.549 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -52.62 -29.91 28.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.543 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -63.45 -32.95 74.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.142 0.496 . . . . 0.0 110.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.41 -58.1 4.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.765 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.529 ' OH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -52.02 -43.41 63.69 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 110.071 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -64.29 -33.73 76.49 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.386 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -64.2 -39.22 93.53 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.575 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.25 -51.33 72.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.394 0.616 . . . . 0.0 110.435 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -65.32 -45.97 82.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.842 0.829 . . . . 0.0 111.333 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -54.42 -25.42 24.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.127 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.12 -12.72 82.96 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 0.0 110.408 179.906 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.45 -0.46 0 CA-C-O 120.948 0.404 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.621 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 74.4 t -57.49 -49.72 92.23 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.971 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 8.7 Cg_endo -47.44 -23.81 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.349 1.366 . . . . 0.0 112.279 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -63.62 -42.56 98.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.089 0.471 . . . . 0.0 110.651 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.423 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.71 -43.91 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.366 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 67.5 mt -69.18 -44.01 81.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.2 0.524 . . . . 0.0 110.569 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -50.72 -26.78 5.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.337 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -72.67 -31.79 65.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.893 0.378 . . . . 0.0 110.278 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.98 -36.17 69.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.529 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -55.82 -39.37 71.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.989 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -65.64 -36.39 83.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -62.84 -51.41 67.14 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.635 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.6 pt -73.02 -43.2 59.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.087 0.47 . . . . 0.0 110.811 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -64.97 -55.2 20.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.687 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 42.7 mtt -98.05 -145.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 p30 -170.63 46.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.153 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.01 -44.72 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.554 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 m -179.97 69.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.148 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -165.08 -134.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.32 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -156.94 -167.44 2.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.346 0.593 . . . . 0.0 110.014 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -83.23 -106.07 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.585 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.461 ' C ' ' H ' ' B' ' 29' ' ' ALA . 21.3 tt -63.0 -34.57 67.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -67.59 8.09 0.4 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.779 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.48 -45.25 39.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.679 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.419 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -60.9 -46.67 89.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.834 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.79 -46.14 67.49 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.516 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -67.56 -54.17 22.21 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.835 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.423 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -61.76 -46.17 90.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.252 0.548 . . . . 0.0 110.669 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.601 ' O ' HG23 ' B' ' 38' ' ' VAL . 68.5 t80 -55.98 -47.11 78.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.741 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.529 ' NH2' ' OH ' ' A' ' 63' ' ' TYR . 76.0 ttt180 -66.16 -34.22 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -62.33 -45.01 95.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 110.649 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 85.5 t -69.26 -44.87 80.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.501 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.601 HG23 ' O ' ' B' ' 34' ' ' TYR . 65.5 t -51.25 -48.19 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.434 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 78.4 p -56.39 -43.05 78.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.473 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' THR . . . . . 0.43 ' O ' ' N ' ' B' ' 44' ' ' ASP . 95.8 m -64.38 -44.62 90.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.674 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 93.1 mt -60.85 -47.29 87.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.508 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.11 -40.84 86.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 110.369 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLN . . . . . 0.483 ' O ' ' C ' ' B' ' 44' ' ' ASP . 94.8 mt-30 -72.97 -32.39 65.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.151 0.5 . . . . 0.0 110.655 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 43' ' ' GLN . 67.0 t0 -28.5 -84.2 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.147 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.51 ' O ' ' N ' ' B' ' 47' ' ' THR . 26.5 pt20 -162.78 9.76 0.06 Allowed 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.47 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' B' ' 45' ' ' GLN . 1.1 tt 26.03 42.0 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.031 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.51 ' N ' ' O ' ' B' ' 45' ' ' GLN . 5.2 t -60.05 -33.01 71.47 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.447 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -154.32 127.43 8.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.592 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -47.45 -33.53 6.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.9 -50.22 57.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.2 t -50.79 -46.46 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.318 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -76.22 -39.93 35.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.378 0.608 . . . . 0.0 111.406 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -66.56 -40.56 89.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.896 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -58.18 -44.87 88.24 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.172 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -65.62 -34.94 79.39 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.977 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.2 mm -69.08 -48.19 70.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.419 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -59.58 -43.5 93.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.128 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -69.86 -45.48 67.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.441 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.404 HD23 ' CE1' ' B' ' 34' ' ' TYR . 51.2 tp -51.57 -28.68 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.03 -29.37 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.394 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.02 -35.5 73.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.61 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.04 -49.39 37.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.773 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -55.48 -42.06 73.84 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.452 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 2.4 t-20 -68.56 -36.84 79.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.281 0.562 . . . . 0.0 110.854 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -60.33 -41.37 93.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.46 -47.85 79.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.67 0.748 . . . . 0.0 110.608 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -44.61 94.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.926 0.87 . . . . 0.0 111.381 -179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -63.74 -21.14 66.26 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.964 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.48 -20.21 14.0 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.666 0.269 . . . . 0.0 110.613 -179.688 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.506 0 CA-C-O 120.956 0.408 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.602 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.6 t -67.31 -39.3 19.77 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.051 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 60.7 Cg_exo -53.08 -25.97 30.88 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 121.834 1.689 . . . . 0.0 111.951 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -60.18 -43.19 96.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 0.0 110.422 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.3 m-85 -57.08 -40.46 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.08 -44.2 84.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.09 0.472 . . . . 0.0 110.352 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -51.13 -30.75 17.41 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.614 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -69.08 -32.07 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.501 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.21 -38.63 66.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.4 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -56.09 -34.01 65.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.105 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -67.77 -33.42 74.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.402 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -65.35 -51.42 60.63 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.785 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.16 -40.07 65.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.321 0.581 . . . . 0.0 110.782 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -67.83 -53.78 24.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.136 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.419 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 44.7 mtt -98.74 -65.0 0.99 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.091 0.472 . . . . 0.0 110.086 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 21.0 t30 80.99 47.91 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.878 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -53.27 -40.76 64.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.299 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.2 p -158.87 64.91 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -161.89 -132.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.334 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 64.5 m-20 -158.66 -172.03 3.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.36 0.6 . . . . 0.0 110.062 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -77.73 -104.62 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.593 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.555 ' C ' ' H ' ' A' ' 29' ' ' ALA . 16.2 tt -63.97 -36.02 75.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.046 0.451 . . . . 0.0 110.768 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -68.05 16.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.92 -44.99 21.46 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.246 0.546 . . . . 0.0 110.263 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.647 ' O ' ' N ' ' A' ' 34' ' ' TYR . 26.3 tpp -61.9 -48.59 79.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.957 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.495 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 62.6 t-20 -47.28 -53.23 14.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.724 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.1 m -62.1 -50.31 72.43 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.959 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 40.8 t80 -67.2 -21.97 65.75 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.647 ' N ' ' O ' ' A' ' 30' ' ' MET . 45.2 t80 -73.91 -60.33 2.31 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.342 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -61.16 -26.33 67.62 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.922 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -66.23 -47.89 72.33 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.708 0.289 . . . . 0.0 110.491 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.6 -48.06 60.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.422 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.455 HG21 ' CE1' ' A' ' 34' ' ' TYR . 99.2 t -62.46 -53.96 40.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.716 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 m -59.7 -18.39 42.02 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.36 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.0 m -87.51 -49.32 7.27 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.102 0.477 . . . . 0.0 111.078 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' CD1' ' HE ' ' A' ' 55' ' ' ARG . 96.6 mt -70.81 -42.85 69.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.66 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 42' ' ' VAL . 43.4 t -78.3 27.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.401 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 41' ' ' LEU . 74.6 mt-30 -147.61 2.92 0.73 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.729 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 46' ' ' LEU . 38.5 t70 -150.37 168.09 25.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.133 0.492 . . . . 0.0 110.278 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.9 tt0 67.31 -64.86 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.504 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.1 mt 36.96 43.34 0.29 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.332 0.587 . . . . 0.0 111.183 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 t -76.53 -31.85 57.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.425 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -170.82 131.32 0.84 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.645 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -50.07 -37.69 34.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.626 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.87 -48.46 71.47 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.315 0.578 . . . . 0.0 110.555 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -53.39 -44.02 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.628 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.12 -36.63 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-O 121.012 0.434 . . . . 0.0 111.09 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.22 -47.66 83.45 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.71 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 15.5 pttp -50.2 -38.44 40.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.206 0.527 . . . . 0.0 110.21 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.428 ' HE ' ' CD1' ' A' ' 41' ' ' LEU . 15.2 mmm180 -64.55 -38.4 90.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.173 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.01 -51.12 73.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.302 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -53.58 -45.29 69.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.367 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.404 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 2.2 m80 -65.08 -38.28 90.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -54.54 -30.43 53.93 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.172 -178.78 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -61.41 -32.1 72.04 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.036 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -59.31 -40.46 86.32 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.199 0.524 . . . . 0.0 110.844 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.63 -49.27 33.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.237 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -49.75 -43.1 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.944 -179.279 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.562 ' ND2' ' CZ ' ' A' ' 68' ' ' ARG . 48.1 t30 -66.95 -35.84 80.87 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.333 0.587 . . . . 0.0 110.372 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 30.7 tptt -69.61 -41.43 75.72 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.507 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -46.19 96.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 122.12 0.962 . . . . 0.0 110.664 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' HD3' HD11 ' A' ' 27' ' ' ILE . 26.7 mmtm -66.84 -43.11 84.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.449 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.562 ' CZ ' ' ND2' ' A' ' 64' ' ' ASN . 78.0 mtm180 -81.51 -15.14 55.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.454 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -92.88 -37.76 5.66 Favored Glycine 0 N--CA 1.471 1.012 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.447 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.7 pp20? . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.055 0.455 . . . . 0.0 110.378 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.231 0.113 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.503 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -56.44 -45.49 99.92 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.197 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 88.5 Cg_exo -45.78 -23.52 1.64 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.533 1.489 . . . . 0.0 112.615 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.91 -39.96 91.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.354 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -60.36 -42.35 95.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.347 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.33 -45.3 98.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.056 0.455 . . . . 0.0 110.437 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -48.61 -28.38 3.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.577 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -74.37 -39.76 62.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.6 mt -69.49 -46.22 67.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.329 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -62.79 -26.06 68.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.459 0.647 . . . . 0.0 110.519 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -63.45 -29.63 70.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.569 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.573 ' NE2' ' O ' ' B' ' 25' ' ' ASP . 82.8 t60 -81.84 -61.56 1.88 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.258 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.418 ' H ' HG23 ' B' ' 18' ' ' ILE . 2.7 pt -50.5 -37.25 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-O 121.385 0.612 . . . . 0.0 110.359 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -74.14 -55.5 6.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.662 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -101.52 -119.76 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.055 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.448 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 21.2 p-10 -176.42 74.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.258 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -79.89 -72.34 0.41 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.221 0.534 . . . . 0.0 110.245 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 28.5 p -172.99 85.19 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.359 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' GLU . . . . . 0.441 ' N ' ' CE1' ' B' ' 17' ' ' HIS . 9.4 tp10 -169.73 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.562 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ASP . . . . . 0.573 ' O ' ' NE2' ' B' ' 17' ' ' HIS . 91.7 m-20 -135.36 -95.9 0.25 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.741 0.305 . . . . 0.0 110.339 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -163.13 -99.51 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.178 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.93 -40.59 89.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.131 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -71.18 -14.53 62.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.462 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.21 -40.4 5.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.76 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.558 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -66.17 -48.36 70.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.744 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.495 ' ND2' ' OD1' ' A' ' 31' ' ' ASN . 39.8 t-20 -57.1 -48.53 78.39 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.694 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 41.1 t -62.51 -44.72 95.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.347 0.594 . . . . 0.0 111.014 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -73.96 -46.75 42.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.869 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.809 ' O ' HG23 ' B' ' 38' ' ' VAL . 50.5 t80 -49.15 -40.46 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.891 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.521 ' NH2' ' CG ' ' A' ' 34' ' ' TYR . 42.7 ttm180 -72.57 -30.22 64.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.088 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 12.5 t -61.56 -43.19 99.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.537 HG12 HD23 ' B' ' 41' ' ' LEU . 87.3 t -73.19 -43.73 56.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 110.577 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.809 HG23 ' O ' ' B' ' 34' ' ' TYR . 88.6 t -54.71 -45.99 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.585 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 42.2 t -58.83 -41.62 87.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.381 . . . . 0.0 110.402 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 31.5 m -72.32 -46.03 57.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.207 0.527 . . . . 0.0 110.775 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.537 HD23 HG12 ' B' ' 37' ' ' VAL . 0.6 OUTLIER -53.33 -30.5 39.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.534 -179.451 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.9 t -90.71 -28.4 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.306 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -73.86 -22.4 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.48 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' B' ' 41' ' ' LEU . 44.9 p30 -79.99 -176.06 5.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.302 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -43.26 141.58 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.688 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -122.9 61.63 1.01 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.24 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.441 HG22 ' H ' ' B' ' 47' ' ' THR . 0.9 OUTLIER -63.45 -31.54 72.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.936 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -168.08 126.84 1.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.848 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ASN . . . . . 0.491 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 23.4 p30 -46.87 -28.46 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.491 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -73.59 -51.25 17.52 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.289 0.566 . . . . 0.0 110.555 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.9 t -49.22 -44.94 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.657 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.0 m -73.4 -35.71 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-O 121.193 0.521 . . . . 0.0 110.742 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.53 -27.97 68.18 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.537 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -53.84 -44.44 70.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.987 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.48 ' HD2' HD11 ' B' ' 41' ' ' LEU . 44.2 mtt180 -68.65 -38.89 80.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.483 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.426 HD12 HG22 ' B' ' 38' ' ' VAL . 32.0 mm -63.33 -52.61 56.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.298 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -57.35 -37.69 72.98 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -74.82 -44.29 50.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.514 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 31.9 tp -55.35 -29.67 58.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.239 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.406 ' OD1' ' OH ' ' B' ' 34' ' ' TYR . 87.9 m-20 -51.58 -38.76 55.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.333 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.75 -30.34 32.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.463 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.44 -54.02 14.05 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.487 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -50.05 -39.07 40.81 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.268 0.556 . . . . 0.0 110.074 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.483 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 50.2 t30 -72.66 -38.83 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' LYS . . . . . 0.418 ' CE ' HH21 ' B' ' 68' ' ' ARG . 46.5 mmtt -61.66 -39.57 91.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.343 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.1 t -60.3 -50.16 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.15 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 17.8 mtmt -72.72 -49.88 28.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.54 0.686 . . . . 0.0 111.661 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.418 HH21 ' CE ' ' B' ' 65' ' ' LYS . 68.8 ttp85 -57.14 -32.22 66.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.86 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.65 -12.72 84.21 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 120.91 0.386 . . . . 0.0 110.559 -179.871 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.51 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -61.24 -43.75 91.09 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.6 Cg_exo -49.59 -27.46 14.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 121.104 1.203 . . . . 0.0 112.267 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.26 -42.45 99.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.527 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -58.61 -44.1 89.81 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 48.3 mt -67.44 -43.71 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.243 0.544 . . . . 0.0 110.595 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -51.94 -33.38 37.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.499 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -67.37 -32.06 72.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.077 0.465 . . . . 0.0 110.4 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.8 mt -71.41 -38.72 71.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.626 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -53.77 -34.37 58.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.046 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -66.8 -36.65 82.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.491 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -61.6 -51.91 66.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.652 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.42 -43.57 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.866 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -65.79 -51.87 55.43 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.472 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 34.9 mtt -104.5 -160.68 0.78 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.151 0.501 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -154.54 51.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.276 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -59.3 -50.56 73.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.962 0.41 . . . . 0.0 110.38 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 p -177.15 71.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.45 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -167.87 -132.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.307 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -155.44 -166.42 2.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.038 0.447 . . . . 0.0 110.406 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.92 -104.27 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.609 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.8 tt -63.41 -39.28 84.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 52.0 t-80 -63.39 10.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.159 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.542 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -76.93 -44.43 31.58 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.003 0.43 . . . . 0.0 110.638 178.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -62.86 -46.64 86.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.012 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' OD1' ' NH2' ' B' ' 35' ' ' ARG . 44.5 t30 -53.58 -48.97 68.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.641 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.4 p -64.77 -54.06 37.24 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.906 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -61.03 -42.72 99.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.316 0.579 . . . . 0.0 110.384 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.416 ' CB ' ' O ' ' A' ' 30' ' ' MET . 44.3 t80 -55.45 -48.06 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -75.56 -20.43 58.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.3 . . . . 0.0 110.471 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.9 t -68.22 -50.8 51.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.489 HG23 ' N ' ' A' ' 38' ' ' VAL . 4.7 m -74.82 -45.94 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.489 ' N ' HG23 ' A' ' 37' ' ' VAL . 55.2 t -56.45 -48.27 80.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.824 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -61.23 -42.26 98.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.4 m -69.31 -46.81 66.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.801 0.334 . . . . 0.0 110.743 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.627 HD22 HH11 ' A' ' 55' ' ' ARG . 82.5 mt -62.66 -30.37 71.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.37 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 38' ' ' VAL . 74.7 t -85.32 -38.01 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.599 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.49 -6.44 19.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.252 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.473 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 54.5 p30 -149.05 165.86 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.901 0.381 . . . . 0.0 110.506 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.484 HE22 ' NH2' ' A' ' 55' ' ' ARG . 51.0 tt0 82.78 -73.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.499 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt 43.52 42.28 3.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.119 0.485 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.8 m -62.27 -37.8 86.85 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.433 0.635 . . . . 0.0 110.227 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 57.9 tttp -178.6 145.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.516 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -57.43 -40.65 78.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.662 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.52 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -66.36 -47.74 72.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.021 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.0 t -53.58 -65.21 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.229 -178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.7 -32.14 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.955 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -41.15 96.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.883 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.402 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 25.1 mtpp -59.67 -41.98 91.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.098 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.627 HH11 HD22 ' A' ' 41' ' ' LEU . 94.0 mtt180 -65.18 -41.83 94.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.056 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.7 -51.55 49.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.429 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.438 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 15.4 mm100 -56.95 -41.19 77.85 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 19.2 m-70 -71.06 -41.88 70.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.689 0.28 . . . . 0.0 110.364 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.47 -22.56 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.598 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 4.3 p-10 -57.41 -30.49 64.98 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.486 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.5 pt-20 -60.7 -33.64 73.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 0.0 110.257 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.11 -57.46 4.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.883 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.98 -39.21 25.71 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.45 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 52.4 t30 -70.87 -39.95 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.931 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -60.66 -46.82 88.86 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 84.3 t -54.83 -55.07 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.163 -0.615 . . . . 0.0 110.326 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HD2' HD11 ' A' ' 27' ' ' ILE . 16.1 mtmt -60.35 -46.22 90.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.177 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.0 tpt85 -58.25 -14.06 6.41 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.719 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.88 9.1 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 . . . . . 0 C--N 1.329 -0.32 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.85 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.231 0.107 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.1 t -72.43 -38.48 5.34 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-O 119.306 -0.378 . . . . 0.0 109.992 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 59.6 Cg_exo -53.48 -28.61 45.5 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.379 1.386 . . . . 0.0 111.806 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -60.64 -44.46 96.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.68 0.276 . . . . 0.0 110.352 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.46 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.1 m-85 -58.18 -37.53 74.93 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.147 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.68 -47.1 72.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.37 -25.91 6.87 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.525 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.31 -31.42 68.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.373 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.69 -39.74 66.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.685 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -32.83 68.09 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.041 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -66.37 -30.65 71.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.573 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -69.16 -51.98 32.74 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.712 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 pt -72.81 -44.44 58.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 121.044 0.45 . . . . 0.0 110.709 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.71 -53.02 57.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.693 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.9 mmt -96.29 -147.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 109.874 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -171.21 45.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.013 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -54.85 -46.12 74.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.659 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t 178.52 68.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.445 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' GLU . . . . . 0.415 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 16.9 tp10 -160.9 -130.99 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.399 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -160.37 -171.81 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.362 0.601 . . . . 0.0 110.369 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -78.44 -106.45 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.132 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.488 ' C ' ' H ' ' B' ' 29' ' ' ALA . 20.0 tt -64.83 -32.79 59.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.615 0.245 . . . . 0.0 110.691 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.09 7.78 0.26 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.608 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.07 -43.0 36.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.267 0.556 . . . . 0.0 110.575 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.476 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 16.2 ptt? -59.45 -47.1 86.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.355 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.476 ' N ' ' CG ' ' B' ' 30' ' ' MET . 33.6 m120 -54.14 -43.41 70.51 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.501 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.415 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 78.3 p -70.65 -55.43 8.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.727 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.46 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 42.2 t80 -59.59 -46.15 89.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.216 0.531 . . . . 0.0 110.598 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.418 ' CB ' ' O ' ' B' ' 30' ' ' MET . 59.4 t80 -55.77 -48.55 75.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.004 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.476 ' NH2' ' OD1' ' A' ' 31' ' ' ASN . 44.5 ttm180 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.393 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.5 t -70.04 -50.99 35.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.896 0.379 . . . . 0.0 110.488 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.0 t -68.18 -56.73 11.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.5 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 69.1 t -48.44 -49.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.328 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 71.3 m -57.81 -36.41 72.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.3 m -71.21 -49.99 37.73 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.949 0.404 . . . . 0.0 111.309 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.3 mt -53.23 -36.62 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.294 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.1 -38.63 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.411 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -115.93 78.16 1.16 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.407 0.622 . . . . 0.0 110.237 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -178.38 -69.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.765 0.793 . . . . 0.0 110.716 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 67.8 tp60 -86.34 -74.89 0.4 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.54 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tt 69.28 43.67 1.04 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.165 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -80.75 -27.69 36.73 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.334 0.587 . . . . 0.0 110.524 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -178.7 145.81 0.32 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 50' ' ' ALA . 18.3 p-10 -64.26 -45.03 89.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.56 -39.93 85.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.832 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 12.6 t -57.93 -62.11 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.845 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -54.19 -33.81 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.574 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.72 -60.63 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.689 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -58.23 -35.59 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.929 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -62.91 -35.72 81.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.078 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 88.4 mt -71.23 -46.2 66.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.492 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -54.75 -25.37 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.14 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.2 -44.97 67.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.211 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.408 HD13 ' HB3' ' B' ' 62' ' ' ALA . 0.5 OUTLIER -51.61 -20.98 2.25 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.591 -179.383 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -59.46 -45.31 91.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.178 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.14 -37.68 88.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.065 0.46 . . . . 0.0 110.654 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' ALA . . . . . 0.408 ' HB3' HD13 ' B' ' 59' ' ' LEU . . . -72.36 -53.89 11.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.913 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.03 -37.71 21.57 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.101 0.476 . . . . 0.0 109.773 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -65.6 -37.21 85.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.652 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 15.5 tptp -55.34 -39.57 70.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.717 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.24 -39.27 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-O 121.836 0.827 . . . . 0.0 110.515 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -64.91 -46.85 79.95 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.803 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -86.05 -12.24 50.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.336 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -92.57 -37.15 5.91 Favored Glycine 0 N--CA 1.476 1.364 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.012 0.434 . . . . 0.0 110.207 -179.879 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.688 0.28 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.464 ' CG1' ' NE2' ' A' ' 58' ' ' HIS . 1.0 OUTLIER -58.52 -46.52 99.6 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.748 179.001 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 99.1 Cg_exo -40.66 -29.78 0.46 Allowed 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 121.248 1.299 . . . . 0.0 112.764 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -59.15 -48.36 81.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.183 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -47.15 85.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.763 0.316 . . . . 0.0 110.26 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.9 mt -61.14 -47.44 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 121.324 0.583 . . . . 0.0 110.41 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -46.27 -32.55 3.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.745 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -60.85 -35.75 77.36 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.2 mp -76.52 -40.06 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.782 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -62.59 -35.43 79.5 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.867 0.365 . . . . 0.0 110.256 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.48 -29.94 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.584 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -72.68 -56.04 5.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.462 HG22 ' HA ' ' A' ' 26' ' ' LYS . 2.1 pt -67.38 -42.33 87.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.335 0.588 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.8 tt0 -62.24 -53.42 55.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.639 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.3 mtt -98.58 -132.4 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -170.35 50.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.449 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -58.1 -50.58 72.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.596 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.0 p -174.19 21.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -134.9 175.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.368 1.08 . . . . 0.0 109.806 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -112.23 -126.5 0.28 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.364 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HA ' HG22 ' A' ' 18' ' ' ILE . 99.4 mttt -113.42 -87.93 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.663 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.4 mm -68.12 -24.17 29.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.683 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -84.67 -9.7 58.0 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.376 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 -51.23 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.828 0.347 . . . . 0.0 110.496 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.556 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -64.14 -41.06 97.35 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.556 ' N ' ' SD ' ' A' ' 30' ' ' MET . 50.3 t30 -56.62 -51.78 67.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.354 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.9 t -65.27 -51.36 61.3 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.773 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -60.71 -53.55 56.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.46 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.428 ' N ' ' O ' ' A' ' 30' ' ' MET . 38.3 t80 -54.84 -48.75 72.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.903 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.3 tpt180 -60.28 -40.03 88.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.918 0.389 . . . . 0.0 110.183 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.1 m -64.8 -41.14 96.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.0 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.23 -60.44 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.63 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 39' ' ' SER . 8.3 p -52.15 -43.42 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.252 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.502 ' N ' HG13 ' A' ' 38' ' ' VAL . 69.6 m -62.53 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -57.94 -43.99 86.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.375 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.21 -45.63 62.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.259 0.552 . . . . 0.0 110.631 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.691 HG12 ' O ' ' A' ' 42' ' ' VAL . 61.0 t -82.33 26.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.29 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -159.98 19.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.319 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -168.77 21.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.231 . . . . 0.0 110.467 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -172.3 62.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.488 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 30.8 mt -100.66 50.52 0.88 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.369 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.2 t -72.31 -34.68 68.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.385 0.612 . . . . 0.0 110.436 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -163.92 132.07 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.439 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 19.4 p30 -48.59 -36.63 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.605 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.439 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -69.18 -53.24 21.05 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 111.03 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.6 t -48.24 -44.31 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.564 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -75.8 -40.16 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.985 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 14.2 mt -59.34 -40.5 86.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.548 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -52.82 -50.2 64.14 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.531 -0.467 . . . . 0.0 109.921 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -62.38 -43.16 99.49 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.259 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.5 mt -64.01 -55.64 20.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.638 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -50.92 -41.26 58.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.167 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.464 ' NE2' ' CG1' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -73.05 -43.45 61.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.902 179.468 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 41.3 tp -56.89 -29.63 63.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.782 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -52.79 -52.56 56.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.246 -0.582 . . . . 0.0 110.377 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -51.39 -29.49 15.81 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.758 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -66.34 -62.26 1.57 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.764 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -43.36 64.69 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -61.61 -25.77 67.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.25 -179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.559 ' NZ ' ' NH2' ' A' ' 68' ' ' ARG . 31.2 tptt -75.1 -32.74 61.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.622 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.5 t -67.21 -52.4 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-O 121.367 0.604 . . . . 0.0 110.465 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -47.17 79.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.84 0.828 . . . . 0.0 111.6 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.559 ' NH2' ' NZ ' ' A' ' 65' ' ' LYS . 70.7 ttp85 -57.17 -24.74 56.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.981 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -84.22 -16.21 67.5 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 121.167 0.508 . . . . 0.0 110.492 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.507 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.4 t -60.58 -41.98 85.86 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.662 -0.685 . . . . 0.0 109.837 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.507 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 79.9 Cg_exo -47.21 -34.27 17.61 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 121.123 1.215 . . . . 0.0 112.223 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -55.45 -41.95 73.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.183 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -44.83 95.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.383 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.414 ' O ' ' N ' ' B' ' 14' ' ' LEU . 30.5 mt -60.61 -48.29 89.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.456 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -45.31 -32.4 1.99 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.66 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -59.14 -35.31 73.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.639 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.0 mp -73.19 -38.22 66.22 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.775 0.321 . . . . 0.0 110.307 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.95 -34.41 77.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.043 0.449 . . . . 0.0 110.315 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -64.51 -28.85 69.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.626 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -72.18 -53.63 12.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.858 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.447 HD12 ' OE1' ' B' ' 70' ' ' GLU . 6.2 pt -70.63 -43.04 77.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.313 0.577 . . . . 0.0 110.729 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.09 -39.55 82.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.204 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -126.0 -135.26 0.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.907 0.385 . . . . 0.0 110.552 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -173.3 55.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.268 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -60.07 -44.82 94.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.285 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t 175.33 71.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -166.25 -124.76 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.798 0.332 . . . . 0.0 110.393 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -156.94 -168.71 2.73 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.312 0.577 . . . . 0.0 110.006 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -89.8 -98.63 0.1 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.37 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.1 mm -61.5 -44.42 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.811 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -57.58 -8.35 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.582 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.66 -48.34 75.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.532 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.427 ' O ' ' N ' ' B' ' 34' ' ' TYR . 2.3 ptm -67.15 -50.31 61.71 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.457 ' OD1' ' NH1' ' A' ' 35' ' ' ARG . 91.5 m-20 -56.89 -44.76 82.62 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.508 -179.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -69.96 -51.23 34.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.805 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.523 ' CE1' HD11 ' B' ' 14' ' ' LEU . 44.5 t80 -63.63 -51.65 64.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.827 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.769 ' O ' HG23 ' B' ' 38' ' ' VAL . 57.0 t80 -52.66 -44.44 66.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.022 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -69.33 -36.7 77.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.573 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 45.1 m -60.55 -39.12 86.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.407 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.74 -54.97 13.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.32 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.769 HG23 ' O ' ' B' ' 34' ' ' TYR . 49.1 t -48.49 -38.21 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.501 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.403 ' O ' ' CB ' ' B' ' 43' ' ' GLN . 77.6 p -64.95 -47.11 78.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.087 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -65.57 -46.12 80.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.445 0.641 . . . . 0.0 111.234 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -62.9 -34.99 78.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.651 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 79.2 t -85.59 -37.99 12.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 39' ' ' SER . 47.8 tt0 -75.93 -0.5 21.66 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.661 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' B' ' 41' ' ' LEU . 46.6 m-20 -157.13 171.54 20.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 52.24 42.36 30.77 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.578 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.98 43.63 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.422 HG23 ' N ' ' B' ' 48' ' ' LYS . 4.6 t -65.4 -43.21 91.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.446 0.641 . . . . 0.0 110.557 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' B' ' 50' ' ' ALA . 28.7 tptp -158.22 131.47 7.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.643 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -46.54 -42.78 16.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.267 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.437 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -62.28 -50.84 70.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.934 179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 28.5 t -51.0 -46.85 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.451 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.424 ' O ' HG12 ' B' ' 56' ' ' ILE . 29.3 m -76.3 -45.09 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 121.594 0.711 . . . . 0.0 111.146 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.417 ' N ' HG23 ' B' ' 52' ' ' VAL . 60.9 tp -56.84 -42.69 80.11 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.606 -178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -53.48 -45.33 69.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.184 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -40.13 90.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.424 HG12 ' O ' ' B' ' 52' ' ' VAL . 26.2 mm -65.43 -52.3 53.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.445 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -52.7 -47.25 67.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.185 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -67.09 -44.88 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.283 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.6 tp -52.17 -27.49 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.319 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -52.16 -45.11 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.348 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -50.07 -28.45 7.16 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.708 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.87 -63.49 1.05 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.705 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -47.47 -46.35 26.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.38 0.609 . . . . 0.0 110.083 -179.74 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.469 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.2 t-20 -59.22 -36.75 75.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.055 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.1 tptp -60.81 -34.29 74.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.439 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 60.0 t -69.92 -51.24 41.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.523 0.678 . . . . 0.0 110.497 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' B' ' 69' ' ' GLY . 5.4 mmmt -72.92 -21.75 60.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.564 1.173 . . . . 0.0 112.359 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -38.54 -27.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.685 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' B' ' 67' ' ' LYS . . . 155.27 66.67 0.01 OUTLIER Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' B' ' 18' ' ' ILE . 60.3 mm-40 . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.762 0.315 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.547 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 4.3 t -67.13 -42.4 40.43 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.107 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 68.2 Cg_exo -49.23 -24.37 8.12 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 121.529 1.486 . . . . 0.0 112.125 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -70.14 -41.29 74.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.183 0.516 . . . . 0.0 110.449 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.414 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -62.81 -47.29 84.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.274 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.11 -42.97 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.342 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -49.27 -25.15 2.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.717 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -75.63 -38.03 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.077 0.465 . . . . 0.0 110.599 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 43.6 mt -63.71 -39.33 94.03 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.548 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -55.32 -36.74 66.54 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.236 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.6 tt0 -65.77 -32.42 73.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.517 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.69 -52.28 46.49 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.806 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 8.3 pt -73.96 -45.94 47.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.848 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 11.6 tm-20 -66.84 -50.37 62.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.426 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 4.1 tpp -94.79 -165.11 1.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.696 0.76 . . . . 0.0 109.934 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -154.56 44.11 0.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.257 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -56.98 -53.36 58.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.177 0.513 . . . . 0.0 110.286 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -174.73 70.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.385 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.71 -135.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.964 0.411 . . . . 0.0 110.204 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -156.57 -165.93 2.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.46 0.648 . . . . 0.0 109.928 -179.447 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.489 ' HZ3' HG12 ' A' ' 27' ' ' ILE . 17.9 ttpp -85.0 -103.23 0.05 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.451 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.532 ' C ' ' H ' ' A' ' 29' ' ' ALA . 3.3 mm -63.02 -38.99 83.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -64.54 8.34 0.12 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.804 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.46 -48.47 22.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.458 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.527 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.45 -43.94 96.33 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.277 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' ' SD ' ' A' ' 30' ' ' MET . 74.8 m-20 -52.42 -46.18 66.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.323 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -70.74 -54.88 10.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.806 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.414 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 44.5 t80 -58.88 -49.26 78.43 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.243 0.544 . . . . 0.0 110.669 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.794 ' O ' HG23 ' A' ' 38' ' ' VAL . 72.0 t80 -58.07 -48.47 80.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.904 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -66.74 -36.27 82.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.958 0.409 . . . . 0.0 110.41 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -62.77 -44.2 96.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.634 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -71.55 -51.83 30.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.374 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 34' ' ' TYR . 88.3 t -51.19 -48.81 31.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.246 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -60.45 -39.61 88.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.2 m -65.7 -48.19 72.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.271 0.557 . . . . 0.0 110.863 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 44' ' ' ASP . 99.1 mt -56.91 -33.36 66.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.758 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -87.34 -38.47 12.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.309 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -53.17 -12.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.664 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.447 ' O ' ' O ' ' A' ' 41' ' ' LEU . 3.4 m-20 -173.01 -172.88 0.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.178 0.513 . . . . 0.0 110.003 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 58.04 33.22 22.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.96 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.63 44.33 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.452 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -64.31 -29.65 70.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.587 . . . . 0.0 110.702 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 87.8 tttt -168.22 131.3 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.713 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -48.42 -38.22 19.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.524 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.491 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -67.05 -49.06 66.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.803 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -51.83 -45.11 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.374 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.481 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.4 m -77.79 -43.72 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.835 0.826 . . . . 0.0 111.116 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.433 ' N ' HG23 ' A' ' 52' ' ' VAL . 5.4 tt -63.69 -41.73 98.1 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.264 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -53.11 -40.01 63.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.987 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.435 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 53.1 mtp180 -67.51 -35.45 79.14 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 52' ' ' VAL . 40.9 mm -65.05 -51.11 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.58 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.448 ' OE1' HG11 ' B' ' 42' ' ' VAL . 27.7 mm100 -57.65 -39.35 76.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.435 ' ND1' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -72.81 -46.37 53.49 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.089 0.471 . . . . 0.0 110.167 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.431 ' N ' ' CG ' ' A' ' 58' ' ' HIS . 29.5 tp -55.71 -25.02 38.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.631 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.39 -34.92 73.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.987 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.28 -32.24 72.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.955 0.407 . . . . 0.0 110.477 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.98 -54.27 13.99 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.81 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -46.71 69.21 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.966 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -62.49 -34.5 76.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.266 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -63.12 -37.85 88.87 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.404 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.8 t -57.86 -53.64 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.197 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -64.69 -44.27 90.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.746 0.784 . . . . 0.0 111.4 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -53.87 -27.86 32.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.019 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -86.09 -15.05 65.6 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 121.106 0.479 . . . . 0.0 110.229 -179.998 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 6' ' ' SER . . . . . 0.456 ' O ' ' HB3' ' B' ' 9' ' ' TYR . 8.4 p . . . . . 0 CA--C 1.53 0.177 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.491 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.8 t -35.77 -54.66 1.31 Allowed Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.701 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 12.6 Cg_endo -51.42 -21.59 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 121.305 1.337 . . . . 0.0 112.331 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 6' ' ' SER . 16.8 t80 -64.98 -47.54 77.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.338 0.589 . . . . 0.0 110.713 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.9 OUTLIER -72.95 -47.54 44.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.359 -179.472 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.5 mt -58.79 -42.15 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.159 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -47.42 -26.03 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.665 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -74.08 -43.64 56.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.508 . . . . 0.0 110.464 179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.96 -36.42 77.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.896 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LYS . . . . . 0.45 ' NZ ' ' OE1' ' B' ' 19' ' ' GLU . 26.3 ttpp -58.78 -46.81 86.67 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.01 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -65.56 -29.05 69.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.578 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -68.19 -52.7 31.47 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.686 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.403 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.4 pt -74.78 -46.2 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.014 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' GLU . . . . . 0.45 ' OE1' ' NZ ' ' B' ' 15' ' ' LYS . 82.7 tt0 -56.0 -54.66 42.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.553 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 45.7 mtt -97.87 -137.53 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.866 0.365 . . . . 0.0 110.039 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -171.38 43.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.305 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -55.99 -47.84 76.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.3 p -173.9 68.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.318 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -166.9 -137.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.927 0.394 . . . . 0.0 110.422 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -156.27 -156.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.397 0.618 . . . . 0.0 109.891 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.403 ' O ' HG22 ' B' ' 18' ' ' ILE . 1.7 ttmp? -93.81 -103.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.978 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.462 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.1 mm -62.18 -39.36 83.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -67.77 7.56 0.49 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.653 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.462 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.75 -48.39 22.0 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.05 0.453 . . . . 0.0 110.651 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.631 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -64.68 -46.05 84.03 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.298 179.51 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.555 ' N ' ' SD ' ' B' ' 30' ' ' MET . 26.0 t-20 -51.18 -52.86 40.22 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.064 -0.655 . . . . 0.0 110.912 -178.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 10.8 t -60.64 -46.84 88.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.791 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 47.1 t80 -72.79 -20.03 61.24 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.623 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.631 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.0 t80 -73.79 -55.43 6.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.289 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.37 -26.59 68.08 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.415 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 82.8 p -66.57 -46.56 75.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.35 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 55.8 t -70.18 -49.63 53.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.149 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.49 -49.28 84.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.361 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -65.5 -17.86 64.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 110.633 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -87.32 -52.02 5.62 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.84 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 43' ' ' GLN . 97.8 mt -66.99 -40.92 87.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.609 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.662 ' O ' HG12 ' B' ' 42' ' ' VAL . 61.7 t -77.89 18.4 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.048 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 41' ' ' LEU . 30.8 mt-30 -145.13 -1.45 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.727 0.299 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -114.2 -30.61 6.58 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.491 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -152.24 86.83 1.3 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.936 0.398 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.13 40.08 1.74 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.506 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -62.81 -17.94 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 110.401 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.682 ' O ' HG22 ' B' ' 51' ' ' VAL . 16.9 tptm -168.19 122.72 0.94 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.184 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -54.43 -15.98 2.01 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.049 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.436 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -80.31 -59.62 2.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.012 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.682 HG22 ' O ' ' B' ' 48' ' ' LYS . 23.1 m -45.93 -36.74 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.58 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.429 ' N ' HG23 ' B' ' 51' ' ' VAL . 32.7 m -77.53 -31.95 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.724 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' B' ' 50' ' ' ALA . 50.1 tp -58.05 -37.91 75.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.948 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.466 ' C ' ' HE ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -58.89 -45.48 90.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.386 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.564 ' HE ' ' N ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -64.3 -44.23 92.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.777 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.38 -51.54 69.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.581 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -56.52 -44.45 80.8 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 47.1 m170 -68.3 -42.09 79.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 tp -52.15 -26.03 10.39 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.741 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.39 -30.13 66.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -61.43 -36.75 81.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.889 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.43 -58.88 3.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -44.22 61.45 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.026 0.441 . . . . 0.0 110.014 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.62 -40.92 98.49 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.306 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 57.2 tttm -66.96 -35.32 79.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.173 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.66 -49.99 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.446 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.27 69.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.798 0.809 . . . . 0.0 111.582 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -63.84 -37.52 87.68 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.027 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.55 -26.9 72.2 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 . . . . . 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.612 -179.624 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 CA--C 1.533 0.309 0 CA-C-O 120.77 0.319 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.58 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.5 t -51.69 -54.2 42.41 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 7.9 Cg_endo -46.99 -16.65 0.32 Allowed 'Trans proline' 0 C--N 1.306 -1.698 0 C-N-CA 122.045 1.83 . . . . 0.0 112.099 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -70.65 -47.13 61.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.114 0.483 . . . . 0.0 110.691 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.431 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.0 m-85 -62.97 -42.51 99.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.465 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 93.9 mt -65.43 -43.62 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.467 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -51.37 -26.27 7.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.436 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -72.95 -36.63 67.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.123 0.487 . . . . 0.0 110.597 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.41 -38.88 85.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.452 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.34 -37.0 74.27 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.105 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' MET . 59.2 tt0 -65.71 -30.27 70.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.651 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -68.63 -52.75 27.98 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.68 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.54 -44.59 53.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 0.0 110.965 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -67.79 -39.45 84.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.216 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.412 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 6.0 ttm -111.66 -163.21 0.84 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.529 0.68 . . . . 0.0 110.247 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -156.79 46.29 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.267 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -58.2 -49.46 76.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.176 0.512 . . . . 0.0 110.387 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -176.21 69.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -165.45 -133.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.272 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -157.0 -165.38 1.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.246 0.546 . . . . 0.0 110.124 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -81.37 -108.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.258 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.558 HD13 ' OE2' ' A' ' 70' ' ' GLU . 5.8 tp -63.87 -35.71 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.44 ' HA ' HD21 ' A' ' 31' ' ' ASN . 75.3 m80 -63.53 5.83 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.577 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.1 -43.15 54.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.5 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -62.6 -44.27 96.73 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.737 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' A' ' 30' ' ' MET . 76.4 m-20 -52.49 -54.8 27.63 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.648 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.0 m -62.05 -55.25 31.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.431 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 55.1 t80 -57.23 -41.0 78.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.187 0.518 . . . . 0.0 110.596 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.43 ' O ' HG22 ' A' ' 38' ' ' VAL . 26.2 t80 -63.67 -52.37 60.99 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.989 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.526 HH12 ' CE ' ' B' ' 30' ' ' MET . 82.4 mtp180 -65.86 -27.14 68.01 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.2 p -72.0 -44.25 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.74 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.1 t -66.87 -63.11 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.763 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 39' ' ' SER . 22.8 m -49.13 -45.84 17.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.338 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.563 ' N ' HG23 ' A' ' 38' ' ' VAL . 64.7 p -58.42 -43.62 88.76 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.202 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.485 ' O ' ' N ' ' A' ' 44' ' ' ASP . 97.0 m -65.49 -46.84 78.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 110.65 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.534 HD22 HH11 ' A' ' 55' ' ' ARG . 88.5 mt -63.65 -43.49 96.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.579 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 42' ' ' VAL . 32.1 t -85.7 29.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.357 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.408 ' H ' ' H ' ' A' ' 44' ' ' ASP . 61.1 tp60 -160.68 -14.27 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.7 0.286 . . . . 0.0 110.796 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' THR . 31.4 t70 -114.37 -34.4 5.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.415 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -96.08 -79.59 0.44 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.543 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.4 mt 52.49 43.27 31.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.977 0.418 . . . . 0.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -88.65 -26.42 21.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.519 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -172.51 134.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.904 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 91.6 m-20 -54.72 -41.32 70.19 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.47 87.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.016 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.08 -43.59 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.523 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 56' ' ' ILE . 34.1 m -76.5 -36.85 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.406 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -59.94 -54.74 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.857 -177.931 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -38.71 92.01 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.428 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.534 HH11 HD22 ' A' ' 41' ' ' LEU . 42.3 ttm180 -65.49 -42.1 92.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.496 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 52' ' ' VAL . 71.3 mt -65.47 -45.79 91.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.497 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -54.63 -36.5 64.59 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.439 ' ND1' ' OE2' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -66.47 -35.53 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.619 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -62.35 -40.24 95.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.522 -177.329 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -50.21 -29.88 10.36 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE2' ' ND1' ' A' ' 58' ' ' HIS . 4.9 pt-20 -60.34 -34.4 73.79 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.418 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.74 -49.26 26.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.954 0.407 . . . . 0.0 110.738 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.86 -38.44 64.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.909 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -69.32 -36.86 77.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.62 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -60.19 -39.27 85.92 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.227 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.83 -47.32 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 122.041 0.924 . . . . 0.0 110.414 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -61.46 -41.42 97.2 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.47 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 55.9 ttt85 -67.53 -14.21 62.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.108 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.59 -63.01 1.12 Allowed Glycine 0 N--CA 1.461 0.363 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.558 ' OE2' HD13 ' A' ' 27' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 120.506 0.193 . . . . 0.0 110.742 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.559 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.4 OUTLIER -64.93 -42.53 63.18 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 70.9 Cg_exo -51.95 -22.25 13.88 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 121.896 1.73 . . . . 0.0 111.984 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -61.91 -42.39 99.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.437 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -64.4 -38.12 89.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.192 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.9 mt -64.23 -44.88 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -49.89 -22.54 1.54 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.573 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -69.7 -40.03 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.328 0.585 . . . . 0.0 110.553 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.04 -36.11 66.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -58.11 -32.83 68.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' B' ' 20' ' ' MET . 57.4 tt0 -75.13 -30.05 60.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.457 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -67.09 -51.44 54.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 0.0 110.661 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.431 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.5 pt -69.93 -41.82 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.497 0.665 . . . . 0.0 110.757 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -73.68 -51.72 15.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.661 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.412 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.0 tpp -90.2 -66.57 0.91 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.11 0.481 . . . . 0.0 110.583 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 t30 76.71 43.07 0.14 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.797 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -55.25 -35.95 65.53 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.332 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 90.8 p -163.45 63.57 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.651 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -161.15 -132.82 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.39 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -153.21 -170.31 3.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.342 0.591 . . . . 0.0 110.316 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.431 ' O ' HG22 ' B' ' 18' ' ' ILE . 59.7 tttp -80.96 -108.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.442 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.658 HD11 ' HD2' ' B' ' 67' ' ' LYS . 21.0 tt -62.22 -38.47 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.34 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' HIS . . . . . 0.414 ' N ' HG23 ' B' ' 27' ' ' ILE . 80.7 m80 -58.48 -12.44 3.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.541 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.12 -41.62 49.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.522 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.545 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -65.38 -51.52 59.82 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.251 179.083 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.537 ' N ' ' SD ' ' B' ' 30' ' ' MET . 42.4 t30 -53.33 -37.28 62.16 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.243 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . 79.5 p -76.73 -52.36 9.74 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.026 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.437 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 85.0 t80 -65.84 -38.16 88.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.398 0.618 . . . . 0.0 110.921 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.545 ' N ' ' O ' ' B' ' 30' ' ' MET . 58.6 t80 -62.08 -56.63 16.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.423 -179.085 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 32' ' ' SER . 36.9 ptt180 -60.47 -25.52 66.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.16 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.19 -45.88 53.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.726 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -67.45 -64.76 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.362 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 39' ' ' SER . 19.4 m -45.41 -41.32 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.474 -179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.502 ' N ' HG23 ' B' ' 38' ' ' VAL . 14.0 t -60.26 -42.08 94.58 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -67.27 -46.12 74.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.797 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.4 mm? -59.84 -37.0 78.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.215 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.1 t -80.77 -38.14 16.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.365 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.38 -11.69 7.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.431 ' O ' ' O ' ' B' ' 41' ' ' LEU . 79.2 m-20 -143.55 161.79 37.55 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 121.318 0.58 . . . . 0.0 110.229 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 47.9 tt0 73.47 162.19 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.997 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 178.26 25.02 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -63.02 -32.07 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.113 0.482 . . . . 0.0 110.404 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -170.67 123.73 0.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.786 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -47.26 -29.71 2.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.437 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.8 -47.04 41.6 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.19 0.519 . . . . 0.0 110.694 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.1 t -50.22 -42.68 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.304 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.3 m -76.14 -33.47 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.11 -40.85 98.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.43 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 36.8 pttt -53.0 -39.01 62.79 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -66.53 -40.75 89.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.132 -179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.72 -50.94 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.297 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -57.88 -39.21 77.28 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.43 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 6.1 m-70 -74.03 -38.13 64.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.109 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 tp -56.07 -30.59 62.2 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.582 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.468 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 91.9 m-20 -52.47 -28.5 20.5 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.495 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -62.1 -35.27 78.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.799 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.01 -53.29 13.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.688 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -45.82 72.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.018 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 75.6 m-20 -63.45 -36.27 83.18 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.002 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' LYS . . . . . 0.412 ' HD2' HH21 ' B' ' 68' ' ' ARG . 34.5 tptt -61.37 -37.8 84.68 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.56 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.9 t -60.5 -58.22 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.284 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.658 ' HD2' HD11 ' B' ' 27' ' ' ILE . 16.4 mtmt -62.13 -47.04 86.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.66 0.743 . . . . 0.0 111.636 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ARG . . . . . 0.412 HH21 ' HD2' ' B' ' 65' ' ' LYS . 55.5 ttp180 -56.03 -15.89 4.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.08 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.81 -16.33 36.55 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 . . . . . 0 N--CA 1.467 0.391 0 CA-C-O 120.656 0.265 . . . . 0.0 110.54 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 30.7 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 110.561 -0.163 . . . . 0.0 110.561 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.48 ' N ' ' OG ' ' A' ' 6' ' ' SER . 3.0 t -58.79 -55.17 48.88 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-O 118.814 -0.612 . . . . 0.0 109.787 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 71.6 Cg_exo -34.04 -31.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.843 0 C-N-CA 121.633 1.555 . . . . 0.0 113.092 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 7' ' ' VAL . 53.3 t80 -63.65 -43.97 95.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.589 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.4 m-85 -61.59 -43.16 99.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.143 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -64.91 -49.01 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.418 0.628 . . . . 0.0 110.668 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -50.69 -25.11 3.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.401 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -73.65 -38.37 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.03 0.443 . . . . 0.0 110.258 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 44.5 mt -63.26 -39.43 94.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.435 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -59.89 -39.61 85.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.101 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -59.08 -26.8 64.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.531 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -73.97 -52.71 11.95 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.113 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -74.18 -43.66 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.222 0.534 . . . . 0.0 110.706 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 67.5 mm-40 -67.33 -48.18 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.355 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 5.8 ttm -96.79 -161.03 0.84 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.373 0.606 . . . . 0.0 109.939 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -157.46 36.68 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.238 -179.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -53.22 -66.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.997 0.427 . . . . 0.0 110.437 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.1 m -163.59 69.6 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.521 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -159.94 -137.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.49 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -154.97 -168.67 2.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.262 0.553 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -81.21 -105.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.335 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.519 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.6 tt -65.29 -35.93 76.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.455 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 49.3 t-80 -65.44 8.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.749 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -74.43 -43.88 54.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.59 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.3 -44.5 94.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.286 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.59 ' N ' ' SD ' ' A' ' 30' ' ' MET . 10.4 t-20 -52.05 -51.34 58.16 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.955 -0.698 . . . . 0.0 110.676 -178.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.0 t -65.16 -54.18 33.67 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.068 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 54.1 t80 -59.29 -43.64 92.54 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.322 0.582 . . . . 0.0 110.729 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.738 ' CE1' HG21 ' A' ' 38' ' ' VAL . 34.4 t80 -59.57 -56.79 17.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.175 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.608 ' NH2' ' CE2' ' B' ' 63' ' ' TYR . 72.8 ttt-85 -61.17 -28.34 69.06 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.166 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 69.2 m -68.69 -44.71 73.4 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.428 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.4 t -70.89 -55.71 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.285 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.738 HG21 ' CE1' ' A' ' 34' ' ' TYR . 98.1 t -52.93 -45.93 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.382 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.2 m -64.82 -21.86 66.87 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.383 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -86.29 -49.85 7.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.342 0.591 . . . . 0.0 111.018 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.485 HD22 ' NH1' ' A' ' 55' ' ' ARG . 86.5 mt -66.17 -43.58 86.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 42' ' ' VAL . 40.8 t -81.04 24.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.52 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -140.53 1.06 1.71 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.445 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 46' ' ' LEU . 44.9 t0 -146.97 167.33 24.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.318 0.58 . . . . 0.0 110.266 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 65.96 -64.4 0.2 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.55 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 44' ' ' ASP . 18.9 mt 37.66 50.19 1.14 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.193 0.52 . . . . 0.0 111.05 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -78.28 -30.45 48.49 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.694 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 88.2 tttt -174.2 132.76 0.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.365 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -50.26 -41.17 49.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.375 0.607 . . . . 0.0 110.833 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.424 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -62.83 -47.58 82.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.683 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 48.2 t -58.56 -47.42 88.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.269 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.0 t -67.89 -42.48 85.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.36 0.6 . . . . 0.0 110.627 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.9 tp -60.17 -43.14 96.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.399 -178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.77 -38.04 60.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.172 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.485 ' NH1' HD22 ' A' ' 41' ' ' LEU . 60.4 mtp180 -67.44 -41.44 84.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.243 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.454 HD12 HG22 ' A' ' 38' ' ' VAL . 33.7 mm -62.96 -51.1 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.478 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -54.98 -43.84 73.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.673 0.273 . . . . 0.0 110.382 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -68.56 -35.25 77.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.249 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -57.19 -39.78 76.08 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.281 -179.027 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -51.19 -26.88 7.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.886 0.374 . . . . 0.0 110.387 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.41 -38.03 88.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.8 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -53.39 11.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.911 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.01 -42.21 48.81 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.42 0.628 . . . . 0.0 109.935 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -63.95 -30.67 71.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.216 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -63.69 -36.86 85.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.488 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 66.5 t -66.17 -43.92 91.8 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-O 121.933 0.873 . . . . 0.0 110.579 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -63.12 -44.95 94.18 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.109 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -72.14 -12.33 61.14 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.048 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -93.73 -33.28 7.14 Favored Glycine 0 N--CA 1.475 1.299 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 110.359 -179.576 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 CA--C 1.522 -0.103 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.533 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 38.3 t -65.8 -40.89 43.14 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.026 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 71.4 Cg_exo -50.23 -13.26 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 120.821 1.014 . . . . 0.0 112.198 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -73.11 -41.03 64.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 110.59 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -73.21 -46.72 48.81 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.542 -179.809 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.82 -45.86 97.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.647 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -50.19 -20.97 1.15 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.257 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -66.91 -36.53 82.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 0.0 110.519 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -74.18 -35.94 64.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.621 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.38 -40.54 68.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.44 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.3 tt0 -65.44 -35.29 80.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.253 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -63.19 -51.84 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.8 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.4 pt -73.83 -45.81 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.106 0.479 . . . . 0.0 110.747 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' B' ' 18' ' ' ILE . 10.7 tm-20 -67.09 -51.06 59.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.355 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.414 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.1 tpp -91.59 -156.28 0.45 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.5 0.667 . . . . 0.0 110.004 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -164.74 41.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.202 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -57.33 -39.34 75.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.592 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t 174.45 70.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.54 -136.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.44 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -157.16 -159.91 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 110.39 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.444 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 63.2 tttm -91.0 -104.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.291 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.483 ' C ' ' H ' ' B' ' 29' ' ' ALA . 39.0 mm -62.47 -41.37 91.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.287 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' HIS . . . . . 0.645 ' HA ' HD21 ' B' ' 31' ' ' ASN . 61.4 t-80 -62.08 2.18 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.693 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.52 -46.53 54.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.61 0.243 . . . . 0.0 110.663 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.485 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -60.13 -42.64 95.26 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.174 179.494 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.645 HD21 ' HA ' ' B' ' 28' ' ' HIS . 75.2 m-20 -52.02 -50.84 60.6 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.788 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 72.1 m -66.52 -56.16 12.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.962 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 80.7 t80 -56.58 -46.23 80.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.053 0.454 . . . . 0.0 110.605 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.438 ' CB ' ' O ' ' B' ' 30' ' ' MET . 79.5 t80 -57.87 -47.32 83.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.986 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 74.7 ttt-85 -71.16 -24.88 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.337 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 36.4 p -72.59 -47.83 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.46 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.78 -56.95 9.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.591 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -48.98 -45.54 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 69.3 m -60.7 -34.82 74.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.771 0.319 . . . . 0.0 110.304 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.8 m -74.15 -47.84 33.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.196 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.5 -36.12 66.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.21 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -81.55 -31.79 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.294 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -124.12 82.73 2.06 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.549 0.69 . . . . 0.0 110.016 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -170.94 -67.03 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.944 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -102.06 -45.51 5.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.933 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 12.2 mt 44.04 60.82 2.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -92.84 -26.58 17.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.367 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.51 138.41 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.65 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -55.73 -43.1 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.162 0.506 . . . . 0.0 110.549 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.39 -43.06 97.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.92 -35.52 65.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.069 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 49.0 t -78.2 -44.44 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.425 0.631 . . . . 0.0 111.028 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.464 HD23 ' O ' ' B' ' 53' ' ' LEU . 1.1 tt -60.86 -51.99 66.97 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.857 -178.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptmm? -57.08 -39.88 75.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.264 0.554 . . . . 0.0 110.214 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.36 -37.88 88.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.336 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.8 mt -66.91 -46.53 84.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.37 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.87 -37.44 68.81 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.445 ' C ' ' ND1' ' B' ' 58' ' ' HIS . 1.4 t-80 -73.31 -37.35 66.2 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.67 ' O ' HD13 ' B' ' 59' ' ' LEU . 1.1 tm? -62.92 -39.96 96.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.78 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.502 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 50.0 m-20 -50.43 -29.72 10.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.443 ' OE1' ' CD2' ' B' ' 58' ' ' HIS . 3.3 pt-20 -59.86 -33.07 71.31 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.669 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.24 -51.19 26.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.61 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.608 ' CE2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -53.34 -44.13 68.23 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.108 0.48 . . . . 0.0 109.766 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 61.8 m-80 -64.48 -32.44 74.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.1 tptp -60.39 -37.01 79.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.587 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.78 -46.29 94.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.724 0.773 . . . . 0.0 110.318 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.15 -47.19 52.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 122.183 0.992 . . . . 0.0 111.901 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -60.51 -26.1 66.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.139 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.22 -63.7 1.57 Allowed Glycine 0 C--N 1.33 0.213 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.719 0.295 . . . . 0.0 110.506 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.295 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.599 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 t -72.5 -38.18 5.02 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.13 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 41.0 Cg_exo -56.35 -22.35 41.08 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 121.565 1.51 . . . . 0.0 111.892 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -60.64 -48.15 83.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.828 0.347 . . . . 0.0 110.285 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.75 -37.37 73.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.087 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -67.94 -44.11 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.006 0.431 . . . . 0.0 110.526 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -51.95 -26.41 10.39 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -72.16 -30.92 65.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.968 0.413 . . . . 0.0 110.21 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.458 HD21 ' CD2' ' A' ' 33' ' ' TYR . 50.3 mt -68.83 -38.89 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.701 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.32 -34.13 73.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.091 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -66.33 -29.36 69.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.595 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 47.6 m170 -71.43 -53.52 13.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.78 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.91 -39.45 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.755 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.28 -55.62 31.49 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.809 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.442 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 69.0 mtm -107.51 -62.77 1.38 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.952 0.406 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 8.2 t30 83.56 51.56 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.795 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -48.19 -41.93 28.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.513 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -160.83 65.87 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.593 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.428 ' C ' HD21 ' A' ' 21' ' ' ASN . 20.2 tp10 -158.72 -134.73 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.418 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 73.4 m-20 -148.14 -166.22 2.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.188 0.518 . . . . 0.0 110.363 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -86.09 -110.03 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.543 HD11 ' HD2' ' A' ' 67' ' ' LYS . 17.9 tt -61.29 -33.63 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 120.797 0.332 . . . . 0.0 110.351 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -67.42 2.05 1.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.672 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.48 79.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.562 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.412 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -63.15 -43.86 97.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.89 179.82 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.609 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -66.2 -53.57 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.86 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.458 ' CD2' HD21 ' A' ' 14' ' ' LEU . 64.1 t80 -61.0 -46.34 91.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.614 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.433 ' CE2' HD23 ' A' ' 59' ' ' LEU . 33.8 t80 -58.77 -42.36 88.77 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.487 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -67.4 -31.21 71.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 0.0 110.199 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.9 t -70.94 -42.69 69.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.1 t -67.32 -61.22 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.479 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 39' ' ' SER . 11.8 p -47.94 -40.88 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.074 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 38' ' ' VAL . 58.6 m -54.0 -47.49 71.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 96.3 m -83.67 -32.49 25.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.664 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.2 tt -56.35 -45.01 80.61 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.149 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 42' ' ' VAL . 77.8 t -68.48 -4.92 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.189 0.518 . . . . 0.0 110.529 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -113.94 -39.89 3.86 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.802 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -46.83 -47.86 21.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.337 0.589 . . . . 0.0 110.097 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -103.15 -91.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.276 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 73.2 35.04 0.96 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.986 0.422 . . . . 0.0 110.191 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 t -98.24 -23.84 15.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.735 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -167.04 131.65 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.753 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -52.24 -34.72 47.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.285 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.03 -48.64 57.13 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.944 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -50.82 -42.75 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.693 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -76.28 -31.98 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.612 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.35 -47.56 83.66 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.673 -178.729 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' CE1' ' A' ' 58' ' ' HIS . 2.1 ptpp? -63.36 -40.92 98.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.393 0.616 . . . . 0.0 110.157 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.403 ' N ' ' HG3' ' A' ' 54' ' ' LYS . 16.1 tpp180 -65.29 -43.58 90.71 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.27 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.63 -44.47 99.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -55.09 -31.23 61.05 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.435 ' CE1' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -71.9 -36.5 70.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 18.6 tp -73.56 -29.09 62.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.471 ' O ' ' CD2' ' A' ' 63' ' ' TYR . 90.8 m-20 -52.53 -38.91 60.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.993 0.425 . . . . 0.0 110.322 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -66.84 -18.7 65.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.486 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -67.13 -61.69 1.8 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.019 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.605 ' CD1' ' NH2' ' B' ' 35' ' ' ARG . 1.0 OUTLIER -56.01 -40.41 73.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.884 0.85 . . . . 0.0 110.154 -179.644 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.468 ' N ' ' CG ' ' A' ' 63' ' ' TYR . 52.2 t30 -62.83 -40.27 96.9 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.468 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -58.16 -42.68 86.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.2 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.482 ' O ' ' N ' ' A' ' 70' ' ' GLU . 72.7 t -62.88 -55.65 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.207 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 27' ' ' ILE . 21.0 mtmt -63.15 -43.05 99.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.513 0.673 . . . . 0.0 111.336 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -66.79 -18.89 65.6 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.11 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 70' ' ' GLU . . . -107.86 -13.11 20.93 Favored Glycine 0 N--CA 1.464 0.554 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 66' ' ' VAL . 4.2 mm-40 . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 121.183 0.516 . . . . 0.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 110.893 -0.04 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 3.2 t -55.24 -54.97 44.62 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 118.903 -0.57 . . . . 0.0 109.808 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 52.3 Cg_exo -34.3 -27.5 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.009 0 C-N-CA 121.7 1.6 . . . . 0.0 113.124 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 7' ' ' VAL . 57.5 t80 -58.35 -37.77 75.84 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.304 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -61.78 -43.18 99.36 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.5 -46.95 82.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.84 0.828 . . . . 0.0 110.738 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -49.32 -23.14 1.29 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.63 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ASN . . . . . 0.414 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 18.5 m120 -74.93 -36.09 62.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.517 0.675 . . . . 0.0 110.595 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' B' ' 14' ' ' LEU . 16.4 mt -69.13 -38.51 78.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.34 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -54.15 -39.98 67.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.165 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -70.71 -31.81 68.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.238 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.469 ' O ' ' ND2' ' B' ' 21' ' ' ASN . 43.2 m170 -66.74 -50.41 62.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.704 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.3 pt -72.93 -36.16 50.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.329 0.585 . . . . 0.0 110.656 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -77.39 -54.65 6.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.069 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 18.8 tpp -81.77 -58.65 2.9 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.257 0.551 . . . . 0.0 110.54 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 17' ' ' HIS . 3.1 m120 69.5 36.76 2.13 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.866 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -60.28 -38.65 84.23 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.276 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.1 m -152.22 60.07 0.84 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.742 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -166.7 -133.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.139 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -158.44 -168.58 2.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.407 0.623 . . . . 0.0 110.358 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -85.8 -104.23 0.06 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.277 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.454 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.4 mm -61.31 -37.34 77.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -64.42 3.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.882 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.454 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.78 -46.81 51.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.828 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.407 ' O ' ' CB ' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -62.5 -50.84 69.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.948 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -58.75 -48.04 82.57 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.447 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -65.34 -53.79 38.54 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.546 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 39.5 t80 -60.11 -53.14 61.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.078 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.414 ' O ' HG22 ' B' ' 38' ' ' VAL . 55.1 t80 -53.44 -42.06 66.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.605 ' NH2' ' CD1' ' A' ' 63' ' ' TYR . 73.0 ttt-85 -68.55 -35.17 77.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.2 t -64.6 -43.0 95.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.486 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.47 ' O ' ' N ' ' B' ' 41' ' ' LEU . 62.2 t -67.1 -65.35 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.594 HG23 ' N ' ' B' ' 39' ' ' SER . 29.9 m -47.64 -49.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.7 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.594 ' N ' HG23 ' B' ' 38' ' ' VAL . 34.2 p -47.48 -61.09 2.09 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 119.994 -0.682 . . . . 0.0 111.401 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -74.62 -44.18 51.84 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.273 1.035 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.47 ' N ' ' O ' ' B' ' 37' ' ' VAL . 51.3 tp -57.31 -34.44 68.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.579 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 38' ' ' VAL . 53.6 t -75.65 -2.28 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.9 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.58 41.04 0.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.401 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -99.12 -59.45 1.72 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.101 0.477 . . . . 0.0 110.389 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -113.19 -31.97 6.45 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.528 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 tt 48.79 68.02 0.77 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.257 0.551 . . . . 0.0 110.163 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.2 t -96.49 -25.34 15.69 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.298 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -180.0 140.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.688 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -61.97 -44.77 96.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.76 86.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 9.0 t -57.93 -62.04 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.704 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 25.5 m -54.03 -33.82 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.434 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -61.72 2.21 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.048 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.32 -34.67 64.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.206 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -65.34 -39.57 92.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 86.5 mt -67.65 -49.97 65.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.335 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -56.52 -38.28 71.63 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.479 ' CE1' ' OE1' ' B' ' 61' ' ' GLU . 34.0 t60 -69.78 -43.29 72.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.32 -27.5 47.49 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.488 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -53.29 -36.71 61.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.435 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.479 ' OE1' ' CE1' ' B' ' 58' ' ' HIS . 5.8 pt-20 -57.72 -31.27 66.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.387 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.43 -58.13 4.05 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.79 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.3 -40.71 49.37 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.032 0.444 . . . . 0.0 109.933 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -68.98 -36.62 78.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.578 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -65.05 -35.77 82.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.616 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 77.6 t -57.24 -52.92 50.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.09 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -69.69 -38.4 76.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.012 0.911 . . . . 0.0 111.664 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -40.85 -32.84 0.25 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.394 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.93 -44.76 5.91 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.056 0.455 . . . . 0.0 110.035 -179.486 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.585 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.9 t -65.84 -40.47 39.32 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.124 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 49.9 Cg_exo -54.19 -26.61 43.19 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 121.79 1.66 . . . . 0.0 112.066 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.19 -41.05 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.281 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.432 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.6 m-85 -60.38 -39.39 87.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.364 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.3 mt -67.79 -45.27 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.979 0.419 . . . . 0.0 110.461 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -48.2 -23.99 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.529 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -74.48 -33.79 62.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 110.685 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.58 -37.51 68.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.314 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -57.26 -41.08 79.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.993 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -67.95 -31.29 70.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.543 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -66.17 -50.69 63.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.819 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 pt -70.92 -39.94 75.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.25 0.548 . . . . 0.0 110.83 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -57.59 -53.86 53.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.252 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 72.8 mtm -114.49 -118.82 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.404 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -171.67 61.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.377 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -73.41 50.35 0.31 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 122.105 0.955 . . . . 0.0 110.96 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 76.79 55.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.136 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -156.51 -134.68 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.21 0.528 . . . . 0.0 110.614 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -159.38 -169.29 2.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.21 -179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.7 tttm -80.71 -105.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.356 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.456 ' C ' ' H ' ' A' ' 29' ' ' ALA . 6.9 tt -65.71 -31.12 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.53 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -69.86 10.33 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.557 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.56 -45.18 22.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.358 0.599 . . . . 0.0 110.872 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.9 ptm -62.01 -50.76 70.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.401 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -53.61 -46.91 70.59 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.397 -178.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -67.05 -53.6 29.59 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.055 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.432 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 47.4 t80 -62.4 -49.63 74.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.385 0.612 . . . . 0.0 110.99 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.507 ' N ' ' O ' ' A' ' 30' ' ' MET . 75.9 t80 -54.56 -47.94 72.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.07 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -65.25 -38.1 89.29 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.4 p -59.89 -43.41 94.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.401 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 98.0 t -70.89 -49.55 49.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.468 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.6 -49.25 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.396 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.8 t -59.02 -35.92 74.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.817 0.341 . . . . 0.0 110.452 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 90.1 m -71.66 -49.77 36.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.412 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -49.74 -34.26 18.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -86.21 -33.48 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.5 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 44' ' ' ASP . 84.3 mt-30 -111.33 81.63 1.47 Allowed 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.989 0.9 . . . . 0.0 109.736 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.458 ' CB ' ' O ' ' A' ' 43' ' ' GLN . 3.6 t70 156.94 136.44 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.204 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.431 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 56.4 tt0 69.21 -62.23 0.41 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt 45.56 70.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.058 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -101.25 -28.9 12.39 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.302 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HE3' ' HB3' ' A' ' 50' ' ' ALA . 34.5 ttpt -178.17 144.83 0.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.232 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -60.91 -41.96 97.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' HE3' ' A' ' 48' ' ' LYS . . . -58.37 -46.18 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.982 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.4 -64.86 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.74 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 53' ' ' LEU . 31.9 m -53.8 -39.69 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.602 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.432 ' N ' HG23 ' A' ' 52' ' ' VAL . 57.4 tp -60.43 -52.27 65.94 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.733 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 49.5 mtpt -52.07 -37.02 52.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.568 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -66.48 -34.28 77.59 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.181 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.7 mt -71.81 -52.77 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.779 -0.369 . . . . 0.0 110.354 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -58.76 -32.98 69.77 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.141 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.4 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -77.12 -46.91 21.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.6 tp -52.23 -27.16 13.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.44 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -51.26 -38.35 52.21 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.397 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -54.71 -33.02 60.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.588 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.49 16.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.549 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.461 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.29 -44.81 68.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.141 0.496 . . . . 0.0 110.318 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -65.83 -35.56 81.02 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.961 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.32 -40.01 94.93 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.416 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.65 -48.81 86.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.455 0.645 . . . . 0.0 110.467 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -44.14 92.38 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.414 1.102 . . . . 0.0 111.698 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -55.77 -27.67 52.15 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.63 -8.5 84.58 Favored Glycine 0 CA--C 1.518 0.262 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 61.6 mm-40 . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 43.7 t . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 120.938 0.399 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.486 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.7 t -57.4 -54.92 49.8 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.148 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 50.2 Cg_exo -35.06 -29.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.117 1.878 . . . . 0.0 113.081 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' TYR . . . . . 0.472 ' N ' ' O ' ' B' ' 7' ' ' VAL . 41.0 t80 -56.22 -41.85 76.3 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.018 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.403 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.8 m-85 -62.11 -40.23 95.18 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 36.3 mt -64.86 -48.78 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 121.295 0.569 . . . . 0.0 110.343 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.85 -26.49 35.71 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.311 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -69.49 -35.57 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.872 0.368 . . . . 0.0 110.235 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.516 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -68.3 -36.92 80.08 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.635 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -56.42 -32.54 64.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.033 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' B' ' 20' ' ' MET . 1.9 pt20 -67.25 -35.06 78.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.378 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -65.33 -50.74 64.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.505 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.8 pt -73.36 -41.73 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.564 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -72.07 -53.77 11.86 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.428 ' N ' ' O ' ' B' ' 16' ' ' GLN . 24.8 ttm -86.47 -69.06 0.7 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.106 0.479 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' B' ' 25' ' ' ASP . 43.2 t30 74.93 45.03 0.16 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.706 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -40.04 -34.35 0.28 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.461 0.648 . . . . 0.0 111.097 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.1 p -167.09 -20.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.659 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -61.42 -132.52 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.917 0.389 . . . . 0.0 110.593 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 69.1 m-20 -155.79 -166.29 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.351 0.596 . . . . 0.0 110.099 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.41 -101.81 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.793 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.7 mm -65.66 -39.69 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.186 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' HIS . . . . . 0.472 ' CD2' ' O ' ' B' ' 28' ' ' HIS . 73.2 t60 -65.64 11.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.278 . . . . 0.0 110.508 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.92 -49.25 18.35 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.938 0.399 . . . . 0.0 110.475 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.594 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -58.01 -39.93 79.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.258 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.565 ' N ' ' SD ' ' B' ' 30' ' ' MET . 93.2 m-20 -49.75 -40.4 40.91 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 22.3 t -80.12 -55.92 4.59 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.619 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.516 ' CD1' HD21 ' B' ' 14' ' ' LEU . 63.4 t80 -58.18 -46.6 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.085 0.469 . . . . 0.0 110.887 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.594 ' N ' ' O ' ' B' ' 30' ' ' MET . 28.9 t80 -57.22 -51.52 68.99 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.897 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 74.9 ttt180 -67.08 -25.94 66.48 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.7 m -70.9 -46.95 61.64 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.566 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' B' ' 40' ' ' THR . 77.8 t -64.95 -65.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.63 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.596 HG23 ' N ' ' B' ' 39' ' ' SER . 23.6 m -45.69 -46.23 4.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.537 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.596 ' N ' HG23 ' B' ' 38' ' ' VAL . 42.0 t -59.67 -26.58 65.66 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' THR . . . . . 0.458 ' O ' ' N ' ' B' ' 44' ' ' ASP . 28.9 m -85.22 -51.12 6.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.779 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.88 -45.05 91.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.78 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 38' ' ' VAL . 69.7 t -58.23 -22.1 18.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.078 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -103.8 -26.79 12.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.577 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' B' ' 40' ' ' THR . 51.3 t0 -56.74 -47.4 80.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.207 0.527 . . . . 0.0 110.766 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -133.38 -167.09 1.87 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.313 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 179.1 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.578 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.438 HG22 ' H ' ' B' ' 47' ' ' THR . 0.0 OUTLIER -62.91 -45.49 92.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.264 0.554 . . . . 0.0 110.284 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -156.89 133.0 9.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -50.24 -25.3 3.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.617 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.612 ' C ' ' HZ2' ' B' ' 54' ' ' LYS . . . -78.16 -53.4 7.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.075 0.464 . . . . 0.0 110.948 179.218 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 23.3 t -46.04 -39.52 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.286 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -77.05 -32.01 19.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.25 0.547 . . . . 0.0 110.599 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 tp -59.95 -29.83 68.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.259 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.612 ' HZ2' ' C ' ' B' ' 50' ' ' ALA . 28.5 mmtm -62.03 -46.7 88.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.453 0.644 . . . . 0.0 110.525 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -64.95 -42.74 94.36 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.399 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 78.4 mt -62.8 -50.1 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.451 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -54.33 -35.76 63.04 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.411 ' O ' ' HG2' ' B' ' 61' ' ' GLU . 36.3 m170 -72.36 -22.3 61.17 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' B' ' 59' ' ' LEU . 0.2 OUTLIER -76.42 -23.97 53.98 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.347 179.611 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.4 -41.67 98.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.452 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' B' ' 58' ' ' HIS . 7.9 pt-20 -61.77 -31.47 71.67 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.947 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.93 -57.86 4.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.532 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -42.97 55.9 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 110.212 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -63.43 -33.72 76.17 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.765 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -64.4 -38.1 89.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.441 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.01 -48.33 89.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.464 0.65 . . . . 0.0 110.4 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -48.21 50.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.211 1.005 . . . . 0.0 111.692 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -59.46 -35.17 73.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.106 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.44 -16.56 75.68 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 121.047 0.451 . . . . 0.0 110.583 -179.893 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 121.055 0.455 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.654 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 57.2 t -65.04 -48.25 71.36 Favored Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 9.0 Cg_endo -47.34 -23.64 3.35 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 121.636 1.557 . . . . 0.0 112.296 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -62.32 -43.69 98.24 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.04 0.448 . . . . 0.0 110.491 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -61.4 -41.93 97.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.103 -179.835 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.4 mt -60.27 -44.2 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.288 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -52.12 -23.95 6.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.753 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -66.58 -38.4 86.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.51 -36.94 65.82 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.812 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptt -52.95 -32.99 48.97 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.143 0.497 . . . . 0.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.5 tt0 -68.95 -33.67 74.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.603 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -63.57 -51.86 63.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.616 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.401 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 9.0 pt -73.96 -45.48 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.291 0.567 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.1 tt0 -67.61 -38.87 84.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.263 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.422 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 5.7 ttm -111.04 -164.07 0.89 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.596 0.713 . . . . 0.0 110.253 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -154.83 45.36 0.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.36 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -56.55 -46.01 80.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.129 0.49 . . . . 0.0 110.408 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t 176.81 67.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.397 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -161.35 -133.72 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 110.358 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -156.69 -168.67 2.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.185 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 60.9 tttp -80.34 -104.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.552 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.7 tt -64.86 -35.46 75.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.65 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -67.44 12.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.623 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -77.93 -45.73 23.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.118 0.485 . . . . 0.0 110.585 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -61.06 -43.94 98.12 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.526 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' A' ' 30' ' ' MET . 26.4 t-20 -50.25 -40.33 47.52 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.493 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -78.59 -55.42 5.21 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.755 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 78.8 t80 -59.49 -48.92 79.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.188 0.518 . . . . 0.0 110.681 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.655 ' O ' HG23 ' A' ' 38' ' ' VAL . 64.7 t80 -54.56 -44.39 72.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.859 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -71.28 -28.02 63.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.9 m -70.03 -48.02 59.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.037 0.446 . . . . 0.0 110.711 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -71.26 -45.26 71.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.466 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.2 t -55.26 -42.48 66.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.29 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.5 p -64.5 -25.9 68.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.78 0.324 . . . . 0.0 110.498 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 94.4 m -84.21 -45.69 12.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.718 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.468 HD22 ' HG2' ' A' ' 55' ' ' ARG . 92.8 mt -58.92 -43.06 91.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.867 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 p -70.79 -27.37 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 121.463 0.649 . . . . 0.0 110.931 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.529 ' O ' ' C ' ' A' ' 44' ' ' ASP . 33.5 mt-30 -86.04 -28.44 24.14 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.629 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.529 ' C ' ' O ' ' A' ' 43' ' ' GLN . 77.0 m-20 -24.96 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 47' ' ' THR . 23.1 pt20 -156.55 7.68 0.2 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.051 0.453 . . . . 0.0 110.627 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.477 ' C ' ' O ' ' A' ' 45' ' ' GLN . 1.0 OUTLIER 27.93 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.486 0.66 . . . . 0.0 111.075 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 45' ' ' GLN . 9.8 t -60.53 -29.92 69.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.588 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -157.99 126.31 5.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.58 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -46.74 -35.82 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.198 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.68 70.37 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.888 0.375 . . . . 0.0 110.697 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.56 -45.07 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.642 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.35 -41.16 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.114 0.483 . . . . 0.0 110.925 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.68 -48.52 74.44 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.052 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.42 -43.58 93.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.802 0.81 . . . . 0.0 110.411 -178.936 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.468 ' HG2' HD22 ' A' ' 41' ' ' LEU . 19.5 tpt85 -63.35 -37.03 85.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.129 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.25 -45.18 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.419 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -57.99 -36.62 72.89 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.381 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.6 m170 -72.63 -43.5 63.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.34 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -53.56 -30.43 41.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.748 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -51.77 -29.2 17.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -60.96 -32.51 72.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.3 -56.56 5.78 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.729 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -44.99 66.36 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.976 0.417 . . . . 0.0 110.121 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.74 -35.53 80.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.0 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -57.34 -42.78 82.61 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.457 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.8 -49.68 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 121.536 0.684 . . . . 0.0 110.484 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.97 -43.38 92.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.82 0.819 . . . . 0.0 111.523 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.05 -23.3 63.63 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.109 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.41 -17.85 20.73 Favored Glycine 0 N--CA 1.465 0.597 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 5.8 mm-40 . . . . . 0 N--CA 1.465 0.323 0 CA-C-O 121.354 0.597 . . . . 0.0 110.323 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 120.98 0.419 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.632 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -55.77 -50.53 86.6 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.807 178.65 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.632 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 5.7 Cg_endo -44.62 -17.49 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.987 1.792 . . . . 0.0 112.217 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' TYR . . . . . 0.437 ' N ' ' O ' ' B' ' 7' ' ' VAL . 81.0 t80 -69.28 -43.01 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.154 0.502 . . . . 0.0 110.433 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -68.21 -46.09 71.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.659 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' B' ' 14' ' ' LEU . 40.6 mt -62.8 -43.61 98.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.086 0.47 . . . . 0.0 110.29 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -46.34 -21.96 0.21 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.205 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ASN . . . . . 0.416 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 46.4 m-20 -73.03 -39.29 66.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.905 0.383 . . . . 0.0 110.363 179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.611 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.3 mp -71.13 -37.01 72.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.64 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -55.98 -42.31 76.1 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.323 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -66.92 -31.63 72.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.416 ' CD2' ' O ' ' B' ' 13' ' ' ASN . 45.1 m170 -66.98 -51.73 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.156 0.503 . . . . 0.0 110.672 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.1 pt -74.11 -43.69 51.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.833 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.7 -53.61 21.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 8.5 tpp -88.15 -157.87 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.5 0.666 . . . . 0.0 109.992 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -157.74 46.28 0.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.321 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -63.03 -51.98 64.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.252 0.549 . . . . 0.0 110.497 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.7 p -174.91 72.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -166.52 -136.2 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.991 0.424 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -157.44 -158.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 64.1 tttm -94.91 -103.01 0.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.431 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 1.6 mm -61.59 -36.71 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.64 4.86 2.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.613 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.98 -50.24 20.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.723 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.543 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -61.46 -43.52 98.73 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.253 179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.543 ' N ' ' SD ' ' B' ' 30' ' ' MET . 75.0 m-20 -53.71 -48.46 69.55 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.587 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -66.91 -53.22 34.16 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.818 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 57.0 t80 -61.79 -50.06 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.26 0.553 . . . . 0.0 110.849 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.642 ' O ' HG23 ' B' ' 38' ' ' VAL . 75.1 t80 -54.71 -45.52 74.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.722 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -68.62 -37.0 79.4 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.617 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 55.2 m -61.96 -44.18 97.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.217 0.532 . . . . 0.0 110.772 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.7 t -72.05 -46.27 59.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.597 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 34' ' ' TYR . 38.0 t -50.47 -44.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.351 -179.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 10.7 t -63.39 -34.64 78.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.191 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -72.61 -49.92 28.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.143 0.497 . . . . 0.0 110.936 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.441 ' CD2' ' NH2' ' B' ' 55' ' ' ARG . 97.3 mt -50.91 -34.93 30.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.948 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.5 t -87.77 -32.81 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.441 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -119.72 82.58 1.91 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.527 0.68 . . . . 0.0 110.176 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -167.64 -71.22 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.998 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.46 HE21 HG22 ' B' ' 47' ' ' THR . 18.6 pt20 -105.54 -38.35 6.48 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.342 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 tp 37.85 54.19 1.56 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.787 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.46 HG22 HE21 ' B' ' 45' ' ' GLN . 2.5 t -83.89 -24.79 30.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.405 ' O ' HG23 ' B' ' 52' ' ' VAL . 35.6 tptt -173.78 138.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.751 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -54.59 -46.15 73.71 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.808 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -45.7 88.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.432 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.67 -34.34 47.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.005 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 48' ' ' LYS . 39.3 t -81.89 -45.07 20.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.591 0.71 . . . . 0.0 111.1 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -52.35 65.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.907 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.437 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.2 pttp -53.36 -40.58 65.06 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.441 ' NH2' ' CD2' ' B' ' 41' ' ' LEU . 77.3 mtp180 -68.34 -37.28 80.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.118 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 4.3 mm -64.38 -50.65 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.459 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -61.39 -37.22 82.61 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.255 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.496 ' CE1' ' OE2' ' B' ' 61' ' ' GLU . 5.7 t-80 -67.55 -46.98 71.16 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.888 0.375 . . . . 0.0 110.233 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.7 tp -49.88 -30.43 10.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.685 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -52.21 -30.83 29.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.7 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.496 ' OE2' ' CE1' ' B' ' 58' ' ' HIS . 9.5 pt-20 -58.1 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.602 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.43 -53.47 28.83 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.836 0.35 . . . . 0.0 110.475 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -46.28 72.04 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 110.193 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.75 -36.67 84.65 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.315 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 30.5 tptt -60.26 -33.6 72.53 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.61 -43.15 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 122.028 0.918 . . . . 0.0 110.515 -178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.406 ' HZ3' ' HB3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -69.0 -44.77 72.13 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.655 -179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -66.82 -21.93 66.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.336 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.69 -70.1 1.24 Allowed Glycine 0 N--CA 1.463 0.453 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' B' ' 26' ' ' LYS . 2.7 pp20? . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 121.686 0.755 . . . . 0.0 111.464 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.924 0.393 . . . . 0.0 110.18 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.577 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -67.66 -41.8 32.16 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.868 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 52.4 Cg_exo -52.85 -24.82 25.25 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.02 1.814 . . . . 0.0 111.92 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -61.62 -47.2 86.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.842 0.353 . . . . 0.0 110.331 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.448 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 2.9 m-85 -59.41 -40.47 86.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.293 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.9 mt -64.71 -43.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-O 121.032 0.444 . . . . 0.0 110.295 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -52.02 -25.76 9.23 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.735 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -73.21 -35.46 66.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.269 0.557 . . . . 0.0 110.621 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.0 mt -70.55 -37.37 74.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.323 -179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -52.28 -39.67 60.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.069 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.01 -31.86 73.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.586 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.32 -51.95 46.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.697 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 10.9 pt -72.95 -44.32 57.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 80.4 tt0 -53.94 -55.34 27.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.45 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 58.2 mtm -113.11 -133.34 0.34 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.921 0.391 . . . . 0.0 110.202 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p30 -171.48 52.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.332 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.489 ' NE2' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -54.74 -45.08 74.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.491 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -174.56 62.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -166.17 -133.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.399 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -157.39 -162.95 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 110.325 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.406 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 64.2 tttm -83.44 -104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.356 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.528 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.8 mt -66.11 -37.42 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -63.69 6.47 0.15 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.612 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.528 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.16 -45.8 22.28 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.466 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.61 -44.85 95.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.479 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.573 ' N ' ' SD ' ' A' ' 30' ' ' MET . 39.2 t30 -51.63 -50.69 59.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.557 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.0 m -65.51 -53.38 43.15 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.633 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.448 ' OH ' ' CD1' ' A' ' 10' ' ' PHE . 4.9 t80 -61.46 -23.46 65.89 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.368 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 30' ' ' MET . 82.8 t80 -76.74 -57.61 3.76 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.376 0.608 . . . . 0.0 110.953 -178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -23.81 66.84 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.979 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.0 p -71.2 -49.88 38.91 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.541 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 79.8 t -70.8 -56.35 11.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.934 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.2 t -49.97 -48.04 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.501 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.2 m -54.96 -52.29 63.5 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.798 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.0 m -68.92 -44.17 73.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.754 0.788 . . . . 0.0 110.981 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -59.72 -40.69 88.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.432 -178.784 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 42' ' ' VAL . 26.5 t -96.0 26.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.106 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -165.9 27.77 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -154.54 17.48 0.46 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.705 0.288 . . . . 0.0 110.541 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.407 ' HG2' ' H ' ' A' ' 47' ' ' THR . 57.1 tt0 -153.38 -77.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.359 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.8 tp 59.41 41.41 19.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 110.642 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 33.8 m -70.85 -40.49 72.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.51 0.671 . . . . 0.0 110.966 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 63.7 tttp -175.53 143.15 0.61 Allowed 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.627 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' HB2' ' B' ' 50' ' ' ALA . 65.7 m-20 -50.08 -45.93 52.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.724 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.4 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -64.07 -46.91 82.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.706 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 49.9 t -57.02 -47.23 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.863 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.557 HG23 ' N ' ' A' ' 53' ' ' LEU . 15.9 m -76.55 -46.65 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.66 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.557 ' N ' HG23 ' A' ' 52' ' ' VAL . 60.0 tp -51.3 -58.6 5.76 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.884 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.472 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 17.5 pttm -50.5 -35.63 30.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.851 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 tpt85 -66.34 -44.7 82.54 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.199 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 50.6 mm -63.57 -52.51 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.487 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -56.61 -39.4 73.54 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.472 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -68.99 -44.0 73.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.273 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 tp -60.2 -33.68 72.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.87 0.367 . . . . 0.0 110.434 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -51.4 -39.55 57.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.541 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.75 -29.16 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.11 -54.0 21.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.773 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.7 -43.06 72.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.158 0.504 . . . . 0.0 110.118 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -66.07 -37.37 85.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.621 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.5 mmpt? -62.0 -34.58 76.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.239 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.58 -46.04 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.363 0.602 . . . . 0.0 110.153 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -67.96 -42.84 80.27 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.497 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -80.67 -10.41 59.73 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.151 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -97.66 -26.12 10.15 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.436 ' OE2' HD11 ' A' ' 27' ' ' ILE . 1.5 pp20? . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 120.893 0.377 . . . . 0.0 110.329 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' SER . . . . . 0.452 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 46.6 t . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.588 0.232 . . . . 0.0 110.845 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.9 t -56.01 -55.59 39.84 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 46.6 Cg_exo -34.82 -26.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.052 1.835 . . . . 0.0 113.126 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 7' ' ' VAL . 89.8 t80 -56.65 -40.07 74.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.356 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.23 -45.39 91.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.072 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.57 -43.99 83.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.319 0.581 . . . . 0.0 110.384 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -50.59 -25.86 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.507 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -76.08 -34.54 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.246 0.546 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.8 mt -73.25 -40.03 64.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.537 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.42 -37.11 74.69 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.997 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.424 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.4 tt0 -66.59 -41.43 88.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -59.08 -49.55 77.45 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.858 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.8 pt -73.31 -40.67 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.618 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -72.06 -60.42 2.24 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.144 -0.623 . . . . 0.0 110.964 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.53 ' SD ' ' N ' ' B' ' 20' ' ' MET . 0.0 OUTLIER -81.43 -66.29 0.91 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.1 t30 75.46 46.84 0.11 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -54.32 -41.35 68.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.008 0.432 . . . . 0.0 110.583 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 38.2 t -161.63 66.09 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.601 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' GLU . . . . . 0.443 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 29.2 tp10 -158.03 -127.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.394 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -160.68 -172.41 3.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.239 0.543 . . . . 0.0 110.109 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -83.38 -103.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.288 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.04 -34.11 64.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.738 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -64.57 -5.56 5.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.28 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.6 -49.95 71.35 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.969 0.414 . . . . 0.0 110.682 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.533 ' O ' ' N ' ' B' ' 34' ' ' TYR . 12.2 tmm? -56.45 -48.35 77.25 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.797 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -52.83 -39.47 62.5 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.388 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.443 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 7.9 t -73.36 -54.5 8.17 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.116 -0.633 . . . . 0.0 110.773 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.409 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 38.0 t80 -63.08 -25.07 68.2 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.082 0.467 . . . . 0.0 110.973 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.721 ' O ' HG23 ' B' ' 38' ' ' VAL . 29.7 t80 -72.82 -51.27 19.55 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.367 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.532 HH22 ' CG ' ' A' ' 31' ' ' ASN . 19.7 ptp180 -72.48 -20.52 61.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.54 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.8 t -70.8 -54.25 12.34 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.71 -178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.511 HG23 ' N ' ' B' ' 38' ' ' VAL . 30.2 m -69.04 -43.39 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.35 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 34' ' ' TYR . 48.3 t -49.97 -51.64 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.412 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 88.5 p -56.76 -45.91 81.75 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.493 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 93.6 m -68.31 -48.37 65.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.073 0.463 . . . . 0.0 110.873 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 78.0 mt -58.12 -45.78 86.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.515 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 73.2 t -69.41 -40.15 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -70.56 -29.33 65.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.901 ' O ' ' O ' ' B' ' 45' ' ' GLN . 38.5 m-20 -103.69 -150.39 0.42 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.831 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.901 ' O ' ' O ' ' B' ' 44' ' ' ASP . 46.2 tt0 34.13 130.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.942 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.51 87.74 1.18 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.625 0.726 . . . . 0.0 109.727 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -141.26 -27.45 0.69 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.344 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -179.21 141.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 111.091 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 15.9 p30 -59.9 -38.5 82.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.565 ' HB2' ' ND2' ' A' ' 49' ' ' ASN . . . -64.32 -39.97 94.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.426 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 38.0 t -61.42 -62.7 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.537 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.52 -31.99 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.34 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 51.4 tp -69.73 -42.2 74.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.34 0.591 . . . . 0.0 110.895 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.474 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 24.1 pttt -53.48 -37.29 62.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.217 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.64 ' HE ' HE22 ' B' ' 45' ' ' GLN . 92.3 mtt-85 -65.15 -30.46 71.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.348 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 20.8 mm -74.52 -46.78 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.33 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -64.47 -24.57 67.66 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.08 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 1.6 m-70 -65.63 -50.47 64.89 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.58 -20.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' B' ' 58' ' ' HIS . 81.6 m-20 -52.29 -45.45 65.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.381 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.401 ' CG ' ' N ' ' B' ' 62' ' ' ALA . 8.2 pt-20 -62.82 -41.13 99.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.529 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' ALA . . . . . 0.401 ' N ' ' CG ' ' B' ' 61' ' ' GLU . . . -71.96 -47.14 54.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.891 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -42.69 58.15 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.102 0.477 . . . . 0.0 109.84 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.78 -36.31 80.24 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.551 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -62.58 -40.86 98.22 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.35 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.9 t -59.75 -50.49 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.253 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -51.19 18.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.078 0.942 . . . . 0.0 111.749 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.52 -36.13 68.84 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.859 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.37 -9.27 67.94 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 . . . . . 0 N--CA 1.467 0.396 0 CA-C-O 121.131 0.491 . . . . 0.0 110.428 179.947 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.032 0.444 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.587 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.1 t -67.33 -39.17 18.89 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.998 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.587 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -52.93 -21.67 16.25 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.896 1.731 . . . . 0.0 112.087 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.22 -43.86 90.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 110.635 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.454 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -64.01 -44.27 93.11 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.584 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.46 HD13 ' HD3' ' A' ' 65' ' ' LYS . 25.1 mt -66.77 -42.26 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.519 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -49.42 -26.06 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.251 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.13 -33.34 70.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.402 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ILE . 36.4 mt -72.15 -37.41 69.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.594 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.48 -38.98 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.136 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -65.55 -35.6 81.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.451 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.09 -51.42 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.654 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 19' ' ' GLU . 13.4 pt -74.45 -43.91 48.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.179 0.514 . . . . 0.0 111.025 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' HG13 ' A' ' 18' ' ' ILE . 82.2 tt0 -64.73 -52.15 58.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.543 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 35.7 mtt -104.75 -161.92 0.85 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.198 0.523 . . . . 0.0 110.022 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -150.78 47.91 0.86 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -57.14 -49.58 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.517 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.4 p -175.45 68.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.496 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -167.12 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.4 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -158.35 -166.25 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.121 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -80.91 -106.07 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.552 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.549 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.3 tt -64.57 -37.14 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 120.954 0.407 . . . . 0.0 110.568 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.85 9.79 0.08 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.588 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.07 -42.64 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -62.01 -47.05 86.52 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.166 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.742 ' C ' HD21 ' A' ' 31' ' ' ASN . 0.1 OUTLIER -51.9 -43.71 63.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.481 -178.773 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.8 m -71.11 -54.11 12.25 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.959 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.454 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 49.5 t80 -61.25 -43.79 98.3 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.746 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 39.2 t80 -58.56 -47.97 82.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.797 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.45 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 81.3 mtp180 -69.16 -27.67 65.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.376 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.7 t -66.46 -46.68 75.58 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.541 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.1 t -68.28 -45.87 81.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.513 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.5 t -51.87 -47.85 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.411 -179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 t -57.32 -42.66 82.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.435 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.9 m -64.88 -45.28 86.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.941 0.4 . . . . 0.0 110.746 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.58 -47.17 85.17 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.614 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.5 t -71.68 -38.33 66.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.781 0.325 . . . . 0.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -71.76 -33.28 68.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.637 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 1.129 ' O ' ' O ' ' A' ' 45' ' ' GLN . 30.5 m-20 -74.59 173.83 9.88 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 1.129 ' O ' ' O ' ' A' ' 44' ' ' ASP . 15.3 pt20 5.64 -164.01 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 117.472 -1.251 . . . . 0.0 113.268 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.11 28.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.553 1.069 . . . . 0.0 109.769 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' N ' ' A' ' 48' ' ' LYS . 8.2 t -60.28 -42.57 95.72 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.334 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.594 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 82.5 tttt -162.82 135.41 5.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.429 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -62.22 -10.17 9.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.533 0.683 . . . . 0.0 111.521 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -73.88 -51.69 15.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.149 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 52' ' ' VAL . 12.0 m -59.26 -56.44 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.524 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.659 ' N ' HG23 ' A' ' 51' ' ' VAL . 4.3 m -51.81 -33.19 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-O 121.379 0.609 . . . . 0.0 110.391 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.426 ' HA ' HD12 ' A' ' 56' ' ' ILE . 5.0 tt -74.68 -29.66 61.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.549 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.2 pttm -51.99 -37.89 54.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.619 0.724 . . . . 0.0 110.315 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -75.71 -37.2 59.65 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.308 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' A' ' 53' ' ' LEU . 67.7 mt -58.66 -50.61 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.14 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -58.62 -37.05 75.04 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -74.55 -39.75 62.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.368 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -53.4 -34.74 58.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.346 -178.583 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -50.26 -26.19 4.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.551 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.99 -37.85 83.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.781 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.97 -49.51 28.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -39.46 34.21 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.938 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -64.74 -41.04 96.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.444 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HD3' HD13 ' A' ' 11' ' ' ILE . 51.8 mtpt -64.26 -33.11 75.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.307 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.04 -42.78 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-O 121.695 0.759 . . . . 0.0 110.344 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HD2' HD11 ' A' ' 27' ' ' ILE . 18.4 mmmt -66.68 -46.86 74.26 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.163 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -78.05 -14.66 59.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.339 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.84 -40.22 5.32 Favored Glycine 0 N--CA 1.47 0.932 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.525 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.2 pp20? . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 110.422 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.861 0.362 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.7 t -71.02 -39.96 9.03 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.892 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 64.6 Cg_exo -52.42 -15.77 4.34 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.987 1.792 . . . . 0.0 112.034 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -67.57 -51.57 49.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.944 0.402 . . . . 0.0 110.378 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.408 ' CD2' HD21 ' B' ' 59' ' ' LEU . 0.2 OUTLIER -61.91 -40.82 96.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.311 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -63.12 -42.8 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.509 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -49.13 -23.78 1.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.586 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.417 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.641 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.1 mp -70.15 -39.72 75.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.533 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -57.14 -31.58 65.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.046 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.97 -35.39 80.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.52 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -62.58 -52.05 64.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.879 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.7 -43.87 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.408 0.623 . . . . 0.0 110.806 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -63.91 -23.8 67.49 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.473 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 36.6 mtt -138.6 -146.89 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.109 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -170.08 39.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.223 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' GLN . . . . . 0.404 ' O ' ' OG ' ' B' ' 23' ' ' SER . 1.1 tm0? -50.99 -40.2 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.967 0.413 . . . . 0.0 110.756 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 5.0 m -177.46 64.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.185 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -164.66 -135.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.312 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -157.23 -161.31 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.26 0.552 . . . . 0.0 110.318 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' LYS . . . . . 0.422 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 62.0 tttm -86.49 -103.59 0.07 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.352 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.517 ' C ' ' H ' ' B' ' 29' ' ' ALA . 44.8 mm -64.6 -40.99 90.97 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -61.16 3.39 0.1 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.789 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.517 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -74.08 -44.87 52.45 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.55 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.576 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.83 -47.23 84.29 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.25 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.576 ' N ' ' SD ' ' B' ' 30' ' ' MET . 2.0 t30 -54.97 -53.36 56.66 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.714 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -62.49 -53.29 57.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.833 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.61 ' CE2' HD11 ' B' ' 14' ' ' LEU . 77.7 t80 -60.38 -49.08 78.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.495 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.437 ' CB ' ' O ' ' B' ' 30' ' ' MET . 35.3 t80 -57.86 -54.56 45.48 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.794 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -61.63 -32.73 72.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 121.155 0.503 . . . . 0.0 110.429 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -68.75 -44.14 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.771 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 38.5 t -66.59 -63.95 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.646 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.578 HG23 ' N ' ' B' ' 39' ' ' SER . 20.2 m -48.5 -45.87 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.518 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.578 ' N ' HG23 ' B' ' 38' ' ' VAL . 46.1 t -60.15 -41.08 91.98 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.281 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -69.0 -49.21 59.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.968 0.413 . . . . 0.0 110.708 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.66 -40.4 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.514 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.672 ' O ' HG12 ' B' ' 42' ' ' VAL . 60.7 t -85.1 19.76 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.076 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -162.12 21.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -161.98 14.14 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -172.6 55.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.545 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 mt -87.67 48.63 1.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.409 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -72.28 -27.17 62.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.31 0.576 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -172.32 133.74 0.67 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.868 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' B' ' 53' ' ' LEU . 58.3 m-20 -52.38 -42.87 64.35 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.465 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.59 86.99 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.939 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -51.97 -44.23 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.434 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.46 -39.75 23.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.185 0.516 . . . . 0.0 110.642 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' B' ' 49' ' ' ASN . 0.2 OUTLIER -55.44 -58.62 7.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.912 -178.4 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -55.71 -37.96 69.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.365 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -64.2 -41.34 97.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.481 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.425 ' O ' ' N ' ' B' ' 59' ' ' LEU . 94.3 mt -65.74 -49.0 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.264 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -49.41 -30.85 8.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.237 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -71.42 -29.24 64.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' B' ' 56' ' ' ILE . 0.4 OUTLIER -77.46 -26.32 51.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.125 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -61.94 -54.6 39.54 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.455 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -62.35 -26.45 68.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.703 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -52.09 17.62 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 120.826 0.346 . . . . 0.0 110.851 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.433 ' CD1' ' C ' ' B' ' 63' ' ' TYR . 0.0 OUTLIER -53.35 -44.68 68.7 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.017 -179.661 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -66.58 -31.17 71.7 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.159 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -63.61 -31.27 72.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.531 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -63.75 -55.44 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.3 0.572 . . . . 0.0 110.656 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -69.8 -46.37 65.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.347 1.07 . . . . 0.0 111.881 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -44.27 -35.93 2.52 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.068 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.49 -55.76 4.15 Favored Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.642 0.258 . . . . 0.0 110.844 -179.782 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.485 ' O ' ' N ' ' A' ' 9' ' ' TYR . 3.2 t . . . . . 0 N--CA 1.472 0.636 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.474 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -34.22 -53.03 0.93 Allowed Pre-proline 0 N--CA 1.482 1.171 0 CA-C-N 118.225 0.466 . . . . 0.0 111.146 178.276 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 11.3 Cg_endo -51.29 -21.17 9.31 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 120.407 0.738 . . . . 0.0 112.671 178.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 6' ' ' SER . 7.3 t80 -62.2 -42.96 99.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.341 0.591 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.1 -52.49 6.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.879 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.2 mt -53.66 -35.85 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.601 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -49.3 -31.07 8.37 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.22 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.476 ' OD1' ' NE2' ' A' ' 17' ' ' HIS . 53.4 t-20 -72.37 -45.34 60.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.211 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 ' CD1' ' A' ' 33' ' ' TYR . 56.5 mt -61.45 -42.5 98.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.613 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.31 -38.84 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -69.04 -33.92 74.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.685 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.476 ' NE2' ' OD1' ' A' ' 13' ' ' ASN . 8.8 m-70 -63.62 -51.74 63.92 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.715 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.5 pt -70.17 -42.54 79.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.119 0.485 . . . . 0.0 110.938 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -57.63 -52.2 66.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.206 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 63.6 mtm -114.29 -125.53 0.28 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.432 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -170.07 61.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.396 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -73.19 51.74 0.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.968 0.889 . . . . 0.0 110.91 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 23' ' ' SER . 3.4 p 77.42 46.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.257 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -147.18 -142.88 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.627 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -153.54 -168.28 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.234 0.54 . . . . 0.0 110.657 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.33 -100.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.176 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.647 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.0 tp -63.53 -42.45 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.467 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.5 m-70 -63.82 19.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.873 0.368 . . . . 0.0 110.99 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.647 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -79.73 -46.7 16.57 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.268 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.557 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.98 -50.64 65.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.252 -179.2 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.478 ' N ' ' SD ' ' A' ' 30' ' ' MET . 82.5 m-20 -51.41 -38.55 54.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.453 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 t -77.2 -54.26 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.615 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.552 ' CD1' HD21 ' A' ' 14' ' ' LEU . 58.4 t80 -63.95 -47.69 79.45 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.18 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.551 ' N ' ' O ' ' A' ' 30' ' ' MET . 57.7 t80 -55.56 -51.77 65.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.751 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.6 ttt85 -63.35 -34.73 78.35 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -63.93 -42.52 97.33 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.364 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.98 -56.83 9.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.376 -0.529 . . . . 0.0 110.171 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.7 t -50.01 -45.35 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.417 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.1 m -68.69 -18.74 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.668 0.27 . . . . 0.0 110.416 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.512 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.4 m -88.63 -54.31 4.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.066 0.46 . . . . 0.0 110.961 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.5 mt -61.5 -39.5 91.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.445 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 p -69.31 -25.53 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.4 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -98.75 -22.13 16.03 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.191 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 40' ' ' THR . 14.3 m-20 -91.04 -34.77 14.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.948 0.404 . . . . 0.0 110.518 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -106.98 161.6 14.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.374 0.607 . . . . 0.0 110.211 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -168.27 22.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.367 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 49.9 m -61.5 -42.99 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.467 0.651 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 8.3 ttmt -173.86 141.51 0.81 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.703 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -48.78 -38.39 21.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.38 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.498 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -69.03 -50.16 51.1 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.351 -0.539 . . . . 0.0 110.765 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 37.5 t -52.41 -43.57 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.499 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.4 m -78.69 -37.92 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.242 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -62.28 -46.29 89.42 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.098 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 17.9 ptmt -54.85 -40.93 70.15 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.03 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.416 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 93.1 mtt180 -63.95 -39.54 94.38 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.824 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.9 mt -69.06 -48.66 68.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.6 -34.4 71.08 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.411 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -76.56 -43.14 40.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.871 0.367 . . . . 0.0 110.358 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.4 tp -48.76 -22.63 0.84 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.447 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 10.8 p-10 -58.6 -26.66 63.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.021 0.438 . . . . 0.0 110.416 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 10.4 pt-20 -60.85 -38.63 86.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.407 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.28 -55.06 10.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.401 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.665 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -51.23 -46.07 62.17 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.264 0.554 . . . . 0.0 110.211 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -61.66 -33.09 73.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.128 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.6 tptm -62.8 -39.61 94.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.85 -48.72 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.339 0.59 . . . . 0.0 110.132 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -42.71 93.54 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 122.016 0.912 . . . . 0.0 111.523 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -60.87 -34.85 75.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.942 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.2 -25.57 28.41 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 110.864 -0.895 . . . . 0.0 110.864 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 121.131 0.491 . . . . 0.0 110.253 -179.442 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.496 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 18.7 t -46.22 -43.27 32.7 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.369 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 23.8 Cg_exo -66.16 -20.75 56.19 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 120.401 0.734 . . . . 0.0 111.805 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.52 -57.43 3.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.341 0.591 . . . . 0.0 110.942 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -43.91 -47.45 8.4 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.622 -178.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 70.4 mt -66.46 -48.19 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.38 0.61 . . . . 0.0 111.234 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.24 -27.82 0.7 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.716 -178.347 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' B' ' 17' ' ' HIS . 18.9 m120 -75.13 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.307 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 34.8 mt -61.63 -43.25 99.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.225 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -59.06 -44.03 91.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 20' ' ' MET . 56.5 tt0 -67.57 -29.5 68.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.89 0.376 . . . . 0.0 110.245 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' B' ' 13' ' ' ASN . 47.8 m170 -67.95 -53.69 24.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -72.97 -43.48 58.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.132 0.492 . . . . 0.0 110.707 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -69.56 -48.36 60.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.353 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.437 ' CB ' ' O ' ' B' ' 16' ' ' GLN . 3.9 tpp -99.94 -163.7 1.05 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.357 0.599 . . . . 0.0 110.19 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -155.78 41.55 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.436 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -58.88 -49.2 78.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.469 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -175.45 69.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -163.8 -148.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.083 0.468 . . . . 0.0 110.201 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -142.76 -164.46 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.363 0.601 . . . . 0.0 110.43 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -88.81 -104.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.441 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.536 HD13 ' OE1' ' B' ' 70' ' ' GLU . 7.0 tp -61.05 -40.67 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' HIS . . . . . 0.452 ' N ' HG23 ' B' ' 27' ' ' ILE . 77.5 m80 -60.02 -14.5 16.59 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.261 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.97 -45.08 51.21 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.525 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 14.0 ptt? -63.4 -52.14 62.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.316 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.525 ' N ' ' CG ' ' B' ' 30' ' ' MET . 97.8 m-20 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.775 -178.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.6 t -63.11 -45.33 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.57 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -75.25 -46.75 31.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.804 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.434 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.2 t80 -49.02 -51.3 31.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.766 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.665 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 67.5 ttt-85 -66.41 -28.94 69.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 5.6 t -62.27 -44.23 97.01 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' B' ' 41' ' ' LEU . 66.4 t -70.79 -58.92 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.862 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -49.43 -49.26 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.763 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 59.7 p -49.04 -61.26 2.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.383 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -73.0 -44.66 60.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 122.443 1.116 . . . . 0.0 111.534 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' B' ' 37' ' ' VAL . 53.6 tp -53.53 -28.51 31.77 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.512 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.686 ' O ' HG12 ' B' ' 42' ' ' VAL . 96.1 t -96.48 21.9 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.16 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -138.05 -2.29 1.89 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.457 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -101.83 -38.62 7.76 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 110.358 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -110.29 174.13 6.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.522 0.677 . . . . 0.0 110.018 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -178.61 26.3 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.208 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -71.7 -34.18 69.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.357 0.598 . . . . 0.0 110.725 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 tptm -169.35 129.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.621 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-20 -49.43 -32.38 11.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.232 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.52 -50.77 34.2 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.318 0.58 . . . . 0.0 110.702 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.9 t -49.49 -43.67 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.447 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -75.98 -36.63 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 120.159 -0.616 . . . . 0.0 111.028 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.51 -35.61 81.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.648 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 65.2 mttm -54.6 -44.63 73.23 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.204 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -69.77 -40.78 75.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 80.1 mt -63.67 -54.65 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.801 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.15 -34.13 69.94 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 5.1 m-70 -76.61 -42.47 42.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.478 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 57.1 tp -47.07 -22.15 0.32 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.583 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 21.7 p-10 -58.94 -28.23 66.06 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.372 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 12.5 pt-20 -56.86 -40.48 76.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.343 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -51.44 32.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.571 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -39.21 15.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 121.035 0.445 . . . . 0.0 109.926 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.42 -34.17 77.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.561 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 tptt -57.32 -42.95 82.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.455 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.41 -47.3 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 122.286 1.041 . . . . 0.0 110.718 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.37 92.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.893 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 -67.02 -16.04 64.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.065 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.52 -63.98 1.12 Allowed Glycine 0 N--CA 1.463 0.441 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.536 ' OE1' HD13 ' B' ' 27' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 110.626 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.722 0.296 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.5 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 78.1 t -59.47 -44.84 98.58 Favored Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-O 119.036 -0.506 . . . . 0.0 109.858 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -44.7 -31.72 5.25 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.241 1.294 . . . . 0.0 112.317 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.55 -43.05 89.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.923 0.392 . . . . 0.0 110.237 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -66.1 -45.54 80.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.458 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.34 -50.44 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.92 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -47.29 -39.94 15.73 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.676 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -51.84 -30.49 23.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.315 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.58 -41.22 63.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.568 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -54.78 -34.13 62.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 120.92 0.391 . . . . 0.0 110.177 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -64.34 -27.44 69.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.333 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.422 ' O ' ' CA ' ' A' ' 21' ' ' ASN . 2.0 m-70 -71.71 -52.86 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.6 pt -73.98 -38.19 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.446 0.641 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -62.58 -44.67 95.73 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.691 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.443 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 28.8 ttp -114.96 -65.06 1.23 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.294 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.443 ' CB ' ' O ' ' A' ' 20' ' ' MET . 5.6 t30 81.48 45.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -55.18 -37.41 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.166 0.507 . . . . 0.0 110.556 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.1 m -158.12 63.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.643 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -159.66 -130.93 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.981 0.419 . . . . 0.0 110.491 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 65.3 m-20 -159.39 167.66 28.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.197 0.523 . . . . 0.0 110.429 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 87.5 tttt -69.9 -99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.454 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.565 ' C ' ' H ' ' A' ' 29' ' ' ALA . 10.7 tp -61.14 -43.15 95.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.015 0.436 . . . . 0.0 110.637 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.503 ' N ' HG23 ' A' ' 27' ' ' ILE . 94.8 m-70 -67.72 17.91 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.642 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -58.97 -51.93 67.96 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' HG21 ' A' ' 66' ' ' VAL . 66.9 mmm -61.68 -44.55 96.74 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.106 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -46.55 -33.69 4.3 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.562 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 m -89.15 -57.11 3.01 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.913 0.387 . . . . 0.0 110.736 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CE2' ' A' ' 10' ' ' PHE . 38.6 t80 -61.37 -53.06 61.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 28.0 t80 -49.01 -49.55 40.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.234 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -66.5 -28.56 68.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.301 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.5 t -63.4 -46.18 87.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.359 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.458 ' O ' ' N ' ' A' ' 41' ' ' LEU . 35.3 t -71.0 -56.34 10.95 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.5 t -51.36 -47.67 34.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.454 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 p -53.82 -60.28 3.52 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.085 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.1 m -69.49 -44.58 70.81 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.919 0.866 . . . . 0.0 111.045 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' A' ' 37' ' ' VAL . 41.8 tp -56.26 -27.77 56.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.598 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 98.6 t -101.87 -33.64 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.205 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -80.16 -0.29 35.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.339 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 43.5 t0 -145.46 165.16 29.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.37 0.605 . . . . 0.0 110.252 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.3 tt0 72.42 -78.28 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.606 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt 42.09 41.15 1.9 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.403 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 11.4 t -73.4 -34.61 65.6 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.397 0.618 . . . . 0.0 110.79 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -167.49 133.68 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.784 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 51.9 m-20 -49.72 -47.07 50.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.664 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.61 83.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.774 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.0 t -52.96 -43.84 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.547 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.451 ' O ' HG12 ' A' ' 56' ' ' ILE . 28.8 m -81.1 -46.33 20.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.161 0.505 . . . . 0.0 110.556 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -57.15 -55.94 28.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.808 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 17.4 ptmt -50.99 -40.02 57.04 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.236 0.541 . . . . 0.0 110.411 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.439 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 40.0 ttm180 -65.08 -39.18 92.84 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.147 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 52' ' ' VAL . 34.3 mm -61.36 -52.95 55.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.247 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -52.52 -40.97 63.03 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.465 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 2.8 t-80 -66.97 -46.16 75.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.11 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 29.3 tp -53.0 -23.65 7.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.917 0.389 . . . . 0.0 110.598 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -55.64 -49.26 73.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.434 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 6.2 pt-20 -50.74 -28.59 9.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.684 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -68.56 -62.22 1.49 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.34 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.573 ' CE2' ' ND2' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -52.47 -38.89 60.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.038 0.447 . . . . 0.0 110.25 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.573 ' ND2' ' CE2' ' A' ' 63' ' ' TYR . 20.9 m120 -65.32 -27.64 68.74 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.165 -179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -75.88 -39.74 55.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.475 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.576 HG21 ' SD ' ' A' ' 30' ' ' MET . 99.1 t -63.03 -52.05 64.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.587 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -63.26 -44.96 93.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.801 0.81 . . . . 0.0 111.072 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 64' ' ' ASN . 12.1 mmm180 -55.34 -31.38 61.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.981 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.96 -22.31 61.53 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.391 . . . . 0.0 110.546 -179.935 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 120.945 0.403 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.549 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -57.32 -42.61 96.9 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.967 179.107 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.9 Cg_exo -50.16 -31.16 27.74 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 121.737 1.624 . . . . 0.0 112.097 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -59.98 -43.87 94.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 110.339 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.455 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -63.79 -46.43 85.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.215 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.3 mt -61.11 -47.04 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-O 121.052 0.453 . . . . 0.0 110.587 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -48.43 -35.0 11.91 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -58.39 -34.31 70.59 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.672 ' N ' HD12 ' B' ' 14' ' ' LEU . 6.6 mp -72.44 -37.23 68.62 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.246 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.82 -38.32 87.7 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.329 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -54.26 -24.93 20.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.556 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.425 ' O ' ' CA ' ' B' ' 21' ' ' ASN . 28.3 m170 -76.38 -54.62 6.49 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -70.84 -38.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.483 0.659 . . . . 0.0 110.625 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -63.72 -43.0 97.83 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 48.9 mtt -115.56 -65.16 1.22 Allowed 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.066 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.444 ' CB ' ' O ' ' B' ' 20' ' ' MET . 24.3 t30 82.9 46.78 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.831 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.7 -40.98 85.22 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.411 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -158.57 69.81 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.576 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -165.17 -125.32 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.076 0.465 . . . . 0.0 110.338 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -158.17 -175.92 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.33 0.586 . . . . 0.0 110.048 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -86.4 -98.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.444 ' C ' ' H ' ' B' ' 29' ' ' ALA . 4.3 mm -61.71 -43.16 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.436 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -62.14 -0.58 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.74 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.444 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.29 -49.86 74.73 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.114 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -68.67 -40.51 80.09 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.283 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' B' ' 30' ' ' MET . 40.7 t30 -55.54 -50.62 69.54 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.668 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.2 t -67.01 -51.45 54.75 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.696 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.604 ' CE1' HD11 ' B' ' 14' ' ' LEU . 54.1 t80 -61.43 -50.0 74.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.478 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' B' ' 30' ' ' MET . 39.4 t80 -55.98 -48.48 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.104 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -64.87 -34.36 78.19 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.857 0.361 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -67.75 -39.07 84.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.646 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.4 HG21 ' CE1' ' B' ' 33' ' ' TYR . 43.0 t -68.97 -63.45 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.401 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.522 HG23 ' N ' ' B' ' 39' ' ' SER . 23.7 m -50.55 -42.31 21.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.369 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.522 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.2 p -62.05 -46.23 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.419 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.1 m -63.65 -44.28 94.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.399 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.504 ' O ' ' O ' ' B' ' 44' ' ' ASP . 90.4 mt -70.37 -50.67 36.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.705 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 62.8 t -60.91 -19.19 19.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.082 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -103.62 6.69 37.3 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.855 0.36 . . . . 0.0 110.854 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.504 ' O ' ' O ' ' B' ' 41' ' ' LEU . 39.7 t0 -148.35 170.12 18.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.606 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.459 HE22 HH12 ' B' ' 55' ' ' ARG . 5.4 pt20 39.88 48.28 2.01 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.352 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.37 46.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.353 -179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.403 HG23 ' N ' ' B' ' 48' ' ' LYS . 3.6 t -61.04 -41.16 96.05 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.204 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.403 ' N ' HG23 ' B' ' 47' ' ' THR . 39.7 tptt -167.32 134.43 2.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.754 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -50.24 -37.51 36.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.539 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.98 -51.27 68.76 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.49 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 36.7 t -50.61 -38.65 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.988 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 5.2 t -80.76 -43.06 20.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.597 0.713 . . . . 0.0 111.008 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.93 -52.75 62.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.141 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.48 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 49.9 pttt -51.34 -42.39 61.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.48 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 78.3 mtp180 -65.71 -45.35 83.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.336 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.78 -54.83 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.739 -0.385 . . . . 0.0 110.362 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -53.2 -40.21 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.313 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 57.0 m170 -75.21 -38.27 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.275 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 52.8 tp -51.75 -32.28 30.03 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.63 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.95 -29.03 11.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.482 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -56.69 -35.57 68.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.6 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -60.83 2.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.486 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -43.43 22.22 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.961 0.41 . . . . 0.0 110.158 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -62.05 -39.66 93.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.293 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 tptm -66.74 -36.63 82.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.441 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.4 -51.07 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.232 0.539 . . . . 0.0 110.355 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -66.33 -48.39 70.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.267 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -61.08 -21.64 63.87 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.219 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.6 -27.11 48.52 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 110.336 -179.878 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.27 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.492 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.0 t -47.56 -42.64 44.77 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 118.854 -0.593 . . . . 0.0 110.245 179.153 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 37.8 Cg_exo -58.62 -22.89 62.71 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 120.754 0.97 . . . . 0.0 111.86 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.77 -48.35 77.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.912 0.387 . . . . 0.0 110.547 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.4 m-85 -48.83 -45.3 40.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.297 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 14' ' ' LEU . 45.9 mt -70.21 -50.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.695 0.76 . . . . 0.0 110.833 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -48.41 -24.13 1.15 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.412 -178.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -72.3 -36.47 68.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.45 . . . . 0.0 110.179 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 11' ' ' ILE . 17.0 mt -70.52 -48.12 57.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.387 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -59.02 -27.8 65.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.287 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -62.53 -27.52 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.18 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.436 ' CE1' ' CA ' ' A' ' 25' ' ' ASP . 58.5 t-80 -81.86 -60.69 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.488 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.417 ' H ' HG23 ' A' ' 18' ' ' ILE . 2.4 pt -50.9 -39.06 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.836 0.827 . . . . 0.0 110.259 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -72.21 -32.15 66.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.458 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.54 -121.77 0.15 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -174.61 72.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.357 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -77.21 -54.98 5.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.13 0.49 . . . . 0.0 110.198 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 m 170.61 78.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.367 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -170.68 -131.54 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.288 0.565 . . . . 0.0 110.219 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.436 ' CA ' ' CE1' ' A' ' 17' ' ' HIS . 71.5 m-20 -152.23 176.53 11.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.3 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -72.89 -102.47 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.506 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.406 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.9 mm -64.29 -41.49 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -55.43 -9.23 0.44 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.204 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.406 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -51.88 -42.64 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.513 ' CG ' ' N ' ' A' ' 31' ' ' ASN . 11.6 ptt? -66.05 -54.62 23.56 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.513 ' N ' ' CG ' ' A' ' 30' ' ' MET . 61.6 t-20 -57.3 -55.01 40.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.649 -178.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -56.39 -51.43 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.642 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 58.5 t80 -63.02 -47.16 84.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 38' ' ' VAL . 22.1 t80 -53.4 -43.88 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.864 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -74.73 -28.32 60.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.827 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 p -64.51 -44.91 89.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.43 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.1 t -72.01 -54.18 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 34' ' ' TYR . 94.3 t -48.53 -47.01 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 -179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.7 t -56.65 -46.94 80.77 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.277 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.4 m -64.57 -45.4 87.2 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.41 0.624 . . . . 0.0 111.272 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.06 -37.83 88.83 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.726 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 42' ' ' VAL . 48.5 t -92.9 25.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.695 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -147.49 -0.89 0.64 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.45 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 46' ' ' LEU . 73.4 m-20 -145.41 170.83 15.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.309 0.576 . . . . 0.0 110.288 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 62.35 -71.56 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.428 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' ASP . 15.8 mt 44.53 70.45 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.277 0.561 . . . . 0.0 110.604 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -109.53 -31.12 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.439 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -171.6 129.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.65 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -49.15 -38.8 26.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.513 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.8 76.92 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.847 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.6 t -54.48 -55.14 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.418 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.415 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.7 m -64.64 -40.71 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.257 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.415 ' N ' HG23 ' A' ' 52' ' ' VAL . 66.0 tp -60.96 -43.1 99.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.359 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 51.1 mtpt -56.66 -41.19 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.08 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -64.41 -39.9 94.75 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 89.9 mt -69.09 -51.92 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -55.42 -38.44 68.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.143 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 5.5 m-70 -73.36 -22.62 60.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -63.02 -34.24 77.14 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 41.0 p-10 -47.2 -25.48 0.93 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.013 0.435 . . . . 0.0 110.381 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.451 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 12.6 pt-20 -58.76 -40.1 82.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.331 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.93 -58.05 4.67 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.395 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -46.19 -43.51 15.31 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.139 0.495 . . . . 0.0 110.076 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.98 -44.69 88.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.696 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -62.64 -39.31 93.46 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.915 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.17 -47.19 91.04 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.67 0 CA-C-O 121.855 0.836 . . . . 0.0 109.929 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -65.13 -43.74 90.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.353 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -74.33 -5.04 39.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.096 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.603 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -106.12 -77.57 1.11 Allowed Glycine 0 N--CA 1.46 0.291 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.603 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 pt-20 . . . . . 0 N--CA 1.494 1.764 0 CA-C-N 115.529 -0.335 . . . . 0.0 111.637 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.539 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.76 -42.33 87.01 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.601 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 51.5 Cg_exo -54.07 -23.64 29.57 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 121.476 1.45 . . . . 0.0 112.094 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -67.01 -39.41 87.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.628 0.252 . . . . 0.0 110.573 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.407 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.37 -40.23 90.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.102 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' ILE . . . . . 0.45 ' O ' ' N ' ' B' ' 14' ' ' LEU . 96.8 mt -68.13 -45.66 82.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.512 0.672 . . . . 0.0 110.796 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -47.76 -25.16 1.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.327 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -73.94 -35.37 64.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.053 0.454 . . . . 0.0 110.166 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 11' ' ' ILE . 29.4 mt -70.89 -39.61 72.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.658 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -57.57 -35.55 70.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.099 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -71.33 -28.91 64.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.632 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 52.0 m170 -67.38 -49.88 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.66 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.86 -43.5 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -59.7 -51.55 69.32 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.373 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 52.1 mtm -118.73 -145.34 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.946 0.403 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -157.49 57.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.344 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 65.2 tp60 -61.11 -45.19 95.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.236 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 t 177.57 69.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -169.73 -133.24 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.402 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -151.01 -166.81 2.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.456 0.646 . . . . 0.0 110.269 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -82.23 -109.46 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.423 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.598 HD11 ' HD2' ' B' ' 67' ' ' LYS . 20.4 tt -65.36 -37.46 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 121.091 0.472 . . . . 0.0 110.552 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -57.37 -22.16 40.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.467 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.98 -33.76 2.16 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.611 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -66.18 -52.75 45.16 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.015 178.599 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.611 ' N ' ' SD ' ' B' ' 30' ' ' MET . 3.0 t-20 -55.35 -50.97 68.26 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.724 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.4 t -61.29 -48.34 81.85 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.407 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 60.0 t80 -70.25 -20.74 63.05 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 40.2 t80 -73.09 -53.1 11.91 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.297 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -68.83 -23.0 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.495 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -70.0 -47.61 61.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.581 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 66.8 t -70.13 -57.9 6.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.106 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.428 ' O ' HG12 ' B' ' 42' ' ' VAL . 76.8 t -48.57 -44.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.428 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 52.8 m -58.49 -34.21 70.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.842 0.353 . . . . 0.0 110.434 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.0 m -82.25 -45.96 14.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.759 0.79 . . . . 0.0 111.372 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.463 ' CD1' ' CZ ' ' B' ' 55' ' ' ARG . 3.2 mm? -64.21 -43.55 94.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.619 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 38' ' ' VAL . 4.3 p -68.17 -20.4 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.054 0.455 . . . . 0.0 109.981 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -98.84 -15.6 19.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -55.64 -47.73 76.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -174.8 126.67 0.29 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 110.565 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 25.0 mt -97.31 39.14 1.2 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.258 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -63.69 -25.35 68.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.684 0.754 . . . . 0.0 110.322 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.727 ' O ' HG22 ' B' ' 51' ' ' VAL . 34.5 tptt -169.41 115.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.826 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 48.4 p30 -50.21 -14.29 0.15 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.174 -0.61 . . . . 0.0 110.985 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.473 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -78.31 -55.1 5.51 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 119.905 -0.718 . . . . 0.0 112.292 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.727 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.3 m -48.35 -37.97 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.837 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -76.35 -33.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.588 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.438 HD13 ' O ' ' B' ' 53' ' ' LEU . 0.2 OUTLIER -62.41 -38.33 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.363 -178.671 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -67.58 -47.15 70.57 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.338 0.59 . . . . 0.0 110.298 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.463 ' CZ ' ' CD1' ' B' ' 41' ' ' LEU . 54.8 mtp180 -61.8 -42.89 99.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.2 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.31 -45.02 94.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.218 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -52.11 -37.78 55.28 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.2 -33.84 76.24 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.02 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.6 ' O ' HD13 ' B' ' 59' ' ' LEU . 0.3 OUTLIER -58.45 -40.82 83.66 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.386 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -51.86 -27.25 12.07 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.961 0.41 . . . . 0.0 110.095 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.31 -40.94 98.73 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.34 -53.54 12.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.834 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.39 -43.05 44.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.058 0.456 . . . . 0.0 109.961 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -64.53 -34.77 79.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.137 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -63.68 -34.37 77.71 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.418 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 99.7 t -65.94 -43.0 92.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 122.058 0.932 . . . . 0.0 110.383 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.598 ' HD2' HD11 ' B' ' 27' ' ' ILE . 19.2 mmmt -66.74 -46.01 76.8 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.207 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -76.24 -19.23 58.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.29 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.98 -33.72 9.46 Favored Glycine 0 N--CA 1.471 1.017 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.4 . . . . 0.0 110.265 -179.877 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.515 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -60.08 -44.8 97.41 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.007 179.453 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 77.3 Cg_exo -48.58 -22.68 4.56 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.645 1.564 . . . . 0.0 112.169 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -73.6 -27.2 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.519 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' O ' ' CD1' ' A' ' 14' ' ' LEU . 1.0 OUTLIER -82.96 -30.38 28.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.135 179.663 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mt -74.05 -52.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 121.691 0.758 . . . . 0.0 111.189 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -52.12 -21.68 3.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.397 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -67.94 -37.18 81.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.684 ' N ' HD12 ' A' ' 14' ' ' LEU . 6.4 mp -69.97 -38.18 76.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.118 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.91 -36.7 72.83 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.883 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.56 -27.12 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -70.48 -53.34 16.68 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.983 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.0 pt -71.43 -40.43 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.088 0.47 . . . . 0.0 110.586 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -65.3 -53.08 49.22 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.889 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' MET . . . . . 0.412 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 40.9 mtt -100.16 -65.22 0.98 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.095 0.474 . . . . 0.0 110.33 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 20' ' ' MET . 19.6 t30 79.02 43.58 0.07 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.933 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -55.41 -44.94 76.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.054 0.454 . . . . 0.0 110.491 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.3 p -150.75 67.37 0.94 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.632 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -166.9 -137.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.536 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -148.22 -163.6 1.82 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.159 0.504 . . . . 0.0 110.354 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.473 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.0 tttm -85.91 -109.89 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.1 mt -62.25 -40.95 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -54.94 -21.35 11.44 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.539 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.18 -39.86 30.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.25 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.583 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.2 -46.1 88.59 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.571 179.171 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.583 ' N ' ' SD ' ' A' ' 30' ' ' MET . 9.8 t-20 -55.89 -47.89 76.59 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.658 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.8 p -65.63 -53.39 42.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.804 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE2' HD11 ' A' ' 14' ' ' LEU . 73.3 t80 -62.14 -47.29 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.689 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 30' ' ' MET . 48.2 t80 -57.51 -48.48 79.16 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.697 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' NH2' ' CD2' ' B' ' 63' ' ' TYR . 6.4 tpt180 -64.32 -30.62 71.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.797 0.332 . . . . 0.0 110.36 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.8 t -69.93 -43.02 72.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.15 -63.15 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.769 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.517 HG23 ' N ' ' A' ' 39' ' ' SER . 30.9 m -47.21 -42.15 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.678 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG23 ' A' ' 38' ' ' VAL . 58.4 m -56.13 -40.36 73.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.828 0.346 . . . . 0.0 110.242 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -71.89 -43.3 65.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.702 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.402 HD22 ' HD2' ' A' ' 55' ' ' ARG . 90.8 mt -62.71 -46.16 89.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.361 -179.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 92.8 t -65.67 -33.1 61.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.096 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -78.9 -18.3 54.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.26 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.938 ' O ' ' O ' ' A' ' 45' ' ' GLN . 42.8 t0 -65.88 169.14 6.98 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 121.217 0.532 . . . . 0.0 109.711 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.938 ' O ' ' O ' ' A' ' 44' ' ' ASP . 18.2 pt20 -13.12 -131.64 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.698 0 CA-C-O 118.51 -0.757 . . . . 0.0 112.684 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 173.75 35.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 118.379 0.536 . . . . 0.0 110.066 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.485 ' HB ' HG21 ' A' ' 51' ' ' VAL . 2.6 m -47.32 -49.58 23.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.209 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.717 ' O ' HG22 ' A' ' 51' ' ' VAL . 16.0 tptp -169.84 134.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.408 ' HA ' HD21 ' A' ' 49' ' ' ASN . 10.9 m120 -48.98 -16.04 0.12 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.421 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.467 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -78.44 -54.82 5.76 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.489 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 48' ' ' LYS . 23.9 m -49.99 -39.29 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.534 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.3 m -77.5 -40.27 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.171 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.1 -37.61 87.89 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.81 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -58.83 -42.16 88.61 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.163 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.402 ' HD2' HD22 ' A' ' 41' ' ' LEU . 40.6 ttm180 -70.63 -40.94 72.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.442 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.41 -50.37 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.427 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -57.0 -38.55 73.25 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -69.0 -38.7 79.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.735 0.303 . . . . 0.0 110.355 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.48 -24.93 14.39 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.62 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 15.2 p-10 -51.56 -28.36 13.64 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.469 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.452 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 9.1 pt-20 -63.47 -31.9 73.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.504 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.66 -60.12 2.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.505 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -39.7 60.58 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.089 0.471 . . . . 0.0 110.415 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.1 -38.82 91.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.481 -178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.3 mmtt -63.35 -33.02 74.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.319 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.58 -46.25 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.523 0.678 . . . . 0.0 110.509 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HZ3' ' HB3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -66.83 -43.19 84.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.471 -179.363 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -87.3 2.63 49.64 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.035 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.08 -38.55 1.13 Allowed Glycine 0 N--CA 1.478 1.473 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.473 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 pp20? . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 120.708 0.29 . . . . 0.0 110.273 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.514 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.86 -44.23 94.18 Favored Pre-proline 0 CA--C 1.543 0.685 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.957 179.42 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.7 Cg_exo -50.03 -21.68 6.72 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 121.703 1.602 . . . . 0.0 112.21 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.94 -42.73 94.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.922 0.391 . . . . 0.0 110.497 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.451 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.9 m-85 -60.8 -43.47 98.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.291 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.37 -43.53 97.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.262 0.553 . . . . 0.0 110.472 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -51.34 -28.39 12.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.501 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.44 -35.7 73.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.212 0.529 . . . . 0.0 110.575 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 37.9 mt -67.68 -38.33 83.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.462 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -56.49 -40.77 75.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 20' ' ' MET . 55.5 tt0 -66.56 -34.86 78.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.323 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -64.0 -51.68 63.11 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.754 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.599 HD11 ' OE2' ' B' ' 70' ' ' GLU . 11.0 pt -73.13 -40.9 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.111 0.481 . . . . 0.0 110.71 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -72.03 -52.51 16.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.773 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.431 ' N ' ' O ' ' B' ' 16' ' ' GLN . 15.3 tpp -87.05 -63.84 1.24 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.16 0.505 . . . . 0.0 110.45 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 69.85 40.77 1.26 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.92 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -53.56 -35.2 60.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.058 0.456 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -165.59 64.44 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.657 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -158.6 -132.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.333 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -153.05 -176.27 5.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.548 0.689 . . . . 0.0 110.081 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -80.81 -105.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.561 ' O ' ' SD ' ' B' ' 30' ' ' MET . 5.3 mm -60.33 -39.84 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -69.21 18.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.096 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.82 -49.51 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.381 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.561 ' SD ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -56.31 -38.01 70.7 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.386 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.54 ' N ' ' SD ' ' B' ' 30' ' ' MET . 58.5 t-20 -50.69 -44.11 57.83 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.321 -178.052 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.7 t -74.46 -54.97 6.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.719 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.451 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 88.2 t80 -59.04 -49.8 76.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.535 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.539 ' N ' ' O ' ' B' ' 30' ' ' MET . 22.7 t80 -55.31 -45.47 76.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -63.98 -33.86 76.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 34.3 t -68.56 -45.08 73.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.503 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' B' ' 41' ' ' LEU . 88.4 t -67.95 -62.7 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.305 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.52 HG13 ' N ' ' B' ' 39' ' ' SER . 8.0 p -48.17 -44.39 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.607 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.52 ' N ' HG13 ' B' ' 38' ' ' VAL . 50.8 p -57.82 -57.9 10.73 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.054 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.3 m -73.59 -43.19 60.34 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 122.39 1.09 . . . . 0.0 111.287 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' B' ' 37' ' ' VAL . 41.8 tp -54.14 -41.57 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.37 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -80.46 -16.55 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -83.21 -17.09 43.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.465 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.507 ' CG ' ' H ' ' B' ' 45' ' ' GLN . 24.5 t0 -104.75 -151.87 0.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.103 0.477 . . . . 0.0 109.715 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.507 ' H ' ' CG ' ' B' ' 44' ' ' ASP . 11.4 tp-100 31.9 -93.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.152 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ASP . 10.3 mt 54.37 75.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.178 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -136.27 -25.54 1.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.579 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -165.06 128.78 2.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -49.48 -33.57 14.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.475 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.63 -49.98 35.03 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.021 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 t -50.58 -45.2 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.379 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.5 -35.88 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.804 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 55.3 tp -62.58 -39.79 94.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.486 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.476 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 93.9 mttt -58.41 -43.01 88.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.23 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -68.74 -40.61 79.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.2 -51.38 73.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -54.23 -39.15 66.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.212 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 32.2 m170 -67.54 -35.05 78.31 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.264 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.512 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.8 OUTLIER -60.99 -37.65 83.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.254 -179.298 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -55.77 -32.71 63.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.417 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -58.96 -35.12 72.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.503 . . . . 0.0 110.453 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.62 19.03 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.85 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.615 ' CD2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -52.1 -50.14 62.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.302 0.572 . . . . 0.0 109.746 -179.537 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.4 t30 -62.44 -32.07 72.88 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.377 -178.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -60.57 -36.76 79.3 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.228 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 59.3 t -64.39 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 123.333 1.54 . . . . 0.0 110.863 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.603 ' C ' ' H ' ' B' ' 69' ' ' GLY . 7.2 mmmt -72.31 -30.67 65.0 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 113.637 -1.619 . . . . 0.0 111.496 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 49.2 ttt85 -55.02 1.06 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.608 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' GLY . . . . . 0.603 ' H ' ' C ' ' B' ' 67' ' ' LYS . . . 97.19 18.53 28.68 Favored Glycine 0 N--CA 1.46 0.235 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.599 ' OE2' HD11 ' B' ' 18' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.499 0.666 . . . . 0.0 110.145 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.689 0.28 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.578 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -68.78 -40.18 16.61 Favored Pre-proline 0 CA--C 1.539 0.549 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.578 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 78.4 Cg_exo -52.08 -27.18 28.2 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 121.731 1.62 . . . . 0.0 111.883 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -61.71 -41.76 98.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -58.15 -39.04 77.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.053 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.634 HG21 ' HD3' ' A' ' 65' ' ' LYS . 54.6 mt -69.8 -45.91 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-O 121.451 0.644 . . . . 0.0 110.507 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -49.11 -24.09 1.5 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.806 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -74.92 -30.04 61.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.544 0.688 . . . . 0.0 110.695 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.426 HD21 ' CG ' ' A' ' 33' ' ' TYR . 25.1 mt -70.04 -39.5 75.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.601 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -51.22 -39.21 56.08 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.258 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -67.29 -36.52 81.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.406 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.62 -51.42 68.58 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.665 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' A' ' 19' ' ' GLU . 15.2 pt -73.84 -43.77 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.267 0.556 . . . . 0.0 110.958 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' A' ' 18' ' ' ILE . 83.8 tt0 -65.55 -54.3 30.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.672 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.5 mtt -101.03 -160.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 109.861 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -151.82 47.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.96 -49.05 74.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.0 p -176.2 65.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.404 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 12.4 tp10 -163.06 -137.02 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.98 0.419 . . . . 0.0 110.203 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -157.79 -166.96 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 110.16 -179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -81.81 -103.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.56 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.551 ' C ' ' H ' ' A' ' 29' ' ' ALA . 4.8 tt -65.12 -36.25 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.509 -179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 83.8 t60 -65.65 11.25 0.07 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.678 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.551 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -80.36 -44.39 19.52 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.921 0.391 . . . . 0.0 110.653 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.493 ' O ' ' N ' ' A' ' 34' ' ' TYR . 12.3 ptt? -58.8 -47.9 83.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.164 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' ' CG ' ' A' ' 30' ' ' MET . 69.6 m-20 -53.06 -53.91 43.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.809 -178.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.42 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 73.3 m -57.99 -51.25 70.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.512 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CE1' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -64.64 -25.52 67.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.124 179.274 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.493 ' N ' ' O ' ' A' ' 30' ' ' MET . 53.9 t80 -71.64 -55.43 7.76 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.054 0.454 . . . . 0.0 110.358 -178.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -65.98 -24.71 66.84 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.454 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -67.23 -51.61 51.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.69 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.45 -55.42 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.6 t -49.48 -53.32 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.662 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -50.35 -56.68 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.842 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 44' ' ' ASP . 18.9 m -61.51 -42.9 99.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.208 0.528 . . . . 0.0 110.521 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.771 HD21 HH11 ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.96 -44.4 94.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.409 -178.508 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 82.6 t -73.55 -40.0 54.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.027 0.442 . . . . 0.0 110.276 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -73.01 -21.39 60.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.708 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.595 ' CG ' ' H ' ' A' ' 45' ' ' GLN . 26.7 t70 -101.36 -152.07 0.43 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.097 0.475 . . . . 0.0 110.008 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.595 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 5.9 tp-100 30.42 -91.97 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.412 0.625 . . . . 0.0 111.425 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 44' ' ' ASP . 7.3 mt 56.74 101.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.041 178.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.519 HG22 HG21 ' A' ' 51' ' ' VAL . 12.1 t -168.29 -28.13 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.897 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.817 ' O ' HG22 ' A' ' 51' ' ' VAL . 38.1 tptt -164.15 129.38 2.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.87 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -51.52 -18.1 1.01 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.989 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -75.9 -57.04 4.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.869 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.817 HG22 ' O ' ' A' ' 48' ' ' LYS . 28.7 m -46.64 -36.31 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.755 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 51' ' ' VAL . 34.1 m -81.72 -33.76 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 178.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 39.4 tp -57.3 -55.86 29.34 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.444 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 18.9 ptmt -52.62 -42.55 64.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.317 0.58 . . . . 0.0 110.291 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.771 HH11 HD21 ' A' ' 41' ' ' LEU . 25.8 mmt85 -61.14 -40.95 95.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.753 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.1 mm -69.68 -49.57 57.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.312 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -56.02 -46.08 78.92 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.495 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -66.98 -45.32 78.0 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.245 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.578 HD11 ' CE1' ' A' ' 33' ' ' TYR . 38.8 tp -50.2 -24.86 3.09 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.794 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -62.93 -32.99 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.241 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -62.34 -39.55 93.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.715 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -58.29 5.71 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.571 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -54.05 -42.07 68.82 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 109.877 -179.729 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.418 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 59.8 t-20 -66.02 -40.87 91.44 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.588 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.634 ' HD3' HG21 ' A' ' 11' ' ' ILE . 62.7 tttm -61.49 -39.59 91.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.44 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.0 t -53.55 -59.88 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.454 -179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.407 ' C ' ' N ' ' A' ' 69' ' ' GLY . 32.0 mtmt -62.45 -46.42 88.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.977 0.894 . . . . 0.0 111.437 -179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -52.11 -15.67 0.62 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.052 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.407 ' N ' ' C ' ' A' ' 67' ' ' LYS . . . -101.16 -13.76 32.67 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 N--CA 1.466 0.352 0 CA-C-O 120.648 0.261 . . . . 0.0 110.369 -179.795 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 6' ' ' SER . . . . . 0.504 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.3 p . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.476 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 3.5 t -35.25 -54.67 1.12 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.076 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 19.3 Cg_endo -53.37 -22.24 20.24 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 121.366 1.377 . . . . 0.0 112.44 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' B' ' 6' ' ' SER . 12.4 t80 -66.98 -44.76 79.6 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.769 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.1 m-85 -71.66 -46.42 58.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.759 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 40.1 mt -61.14 -44.83 99.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.275 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -49.8 -31.39 11.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.231 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ASN . . . . . 0.465 ' ND2' ' NE2' ' B' ' 17' ' ' HIS . 5.4 t-20 -71.38 -43.44 66.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.386 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' B' ' 33' ' ' TYR . 46.2 mt -62.67 -39.09 92.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.244 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.258 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -75.2 -28.22 59.92 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.014 0.435 . . . . 0.0 110.696 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.465 ' NE2' ' ND2' ' B' ' 13' ' ' ASN . 34.7 m170 -65.43 -51.49 59.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' B' ' 19' ' ' GLU . 3.7 pt -73.08 -44.55 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.085 0.469 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 19' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' B' ' 18' ' ' ILE . 72.0 mm-40 -67.48 -50.43 59.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.129 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.0 tpp -94.0 -152.81 0.35 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.538 0.685 . . . . 0.0 109.98 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.97 41.92 0.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.003 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -55.25 -50.5 69.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.237 0.541 . . . . 0.0 110.491 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 36.7 p -174.62 65.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.289 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -162.86 -146.9 0.11 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.913 0.387 . . . . 0.0 110.403 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -144.44 -163.41 1.68 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.113 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -81.54 -108.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.5 mt -64.72 -42.26 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -50.16 -28.79 7.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.82 -31.67 1.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.728 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -65.82 -50.69 63.71 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.355 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' B' ' 30' ' ' MET . 10.8 t30 -57.56 -56.73 18.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.964 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 63.7 p -54.54 -45.57 73.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 76.3 t80 -70.15 -34.53 73.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.538 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' B' ' 30' ' ' MET . 25.3 t80 -61.65 -47.81 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.612 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.482 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.7 mpt_? -69.51 -26.48 64.55 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -68.68 -46.38 69.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.8 t -64.89 -66.12 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.544 -0.863 . . . . 0.0 110.835 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.491 HG23 ' N ' ' B' ' 39' ' ' SER . 25.1 m -44.6 -39.82 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.577 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.491 ' N ' HG23 ' B' ' 38' ' ' VAL . 11.0 t -60.73 -44.93 96.02 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.142 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.7 m -69.67 -46.47 66.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 0.0 110.998 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.413 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -60.28 -33.74 72.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.46 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -87.63 -37.58 10.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -73.12 -14.97 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.672 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' B' ' 41' ' ' LEU . 33.6 t70 -143.67 160.52 40.55 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.484 0.659 . . . . 0.0 110.051 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 41.25 63.35 1.25 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.083 -179.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.87 42.11 1.68 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.56 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' THR . . . . . 0.493 HG22 HG21 ' B' ' 51' ' ' VAL . 9.1 t -54.92 -44.01 73.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.764 0.792 . . . . 0.0 110.455 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.809 ' O ' HG22 ' B' ' 51' ' ' VAL . 38.2 tptt -146.81 127.44 14.22 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.881 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -50.19 -15.03 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.939 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.409 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -77.08 -55.79 5.14 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.596 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.809 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.2 m -48.08 -38.0 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.773 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.68 -34.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.144 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.14 -42.25 90.24 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.427 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -56.29 -43.81 79.23 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.018 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.29 -45.06 93.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.93 -52.04 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.786 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -55.32 -41.39 72.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.391 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.21 -38.83 63.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.331 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 5.8 tt -52.63 -26.2 12.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.082 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -52.43 -28.59 20.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.438 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.46 -32.85 74.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.91 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.75 -62.92 1.21 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.748 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.49 -38.97 14.87 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -65.07 -38.55 91.15 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.128 0.49 . . . . 0.0 110.071 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 65' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.2 tptp -63.33 -33.07 74.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.179 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 60.6 t -62.57 -46.75 95.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.928 0.87 . . . . 0.0 110.466 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -71.52 -43.0 67.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.203 1.001 . . . . 0.0 112.011 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 29.6 mmm-85 -79.09 -14.14 59.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.478 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -95.88 -42.12 3.65 Favored Glycine 0 N--CA 1.469 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.802 0.334 . . . . 0.0 110.329 -179.934 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.451 -0.398 0 CA-C-O 121.22 0.533 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.528 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -52.42 -50.25 80.97 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.143 179.07 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 58.1 Cg_exo -41.59 -27.64 0.53 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 121.845 1.697 . . . . 0.0 112.32 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -60.48 -39.43 87.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 110.205 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.8 m-85 -58.05 -47.05 84.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -66.1 -47.14 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.465 0.65 . . . . 0.0 110.62 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -50.61 -28.55 8.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.62 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -72.36 -37.78 68.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.37 0.605 . . . . 0.0 110.648 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 14.3 mt -67.53 -35.19 78.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.163 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -52.16 -41.85 62.92 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.34 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -68.01 -36.46 80.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.834 0.35 . . . . 0.0 110.675 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.1 -49.3 78.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.721 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.451 HG13 ' N ' ' A' ' 19' ' ' GLU . 27.0 pt -73.24 -41.43 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.783 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.451 ' N ' HG13 ' A' ' 18' ' ' ILE . 47.6 tp10 -55.06 -53.98 48.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.311 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 17.9 ptp -121.25 -134.59 0.31 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.241 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -159.88 53.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.159 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -55.7 -46.41 77.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.3 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.0 p -175.42 57.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -164.71 -139.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.285 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -147.86 -166.3 2.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.349 0.595 . . . . 0.0 110.54 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.5 -105.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.471 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.5 HG23 ' N ' ' A' ' 28' ' ' HIS . 17.4 tt -63.96 -41.83 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.163 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.5 ' N ' HG23 ' A' ' 27' ' ' ILE . 95.5 m-70 -55.65 -11.58 0.97 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.592 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.84 -42.83 48.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.593 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.1 ptm -65.98 -54.76 22.03 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.194 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 30' ' ' MET . 19.0 t-20 -51.61 -47.83 63.48 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.495 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.9 t -68.31 -54.54 16.72 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.648 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.412 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 42.8 t80 -60.63 -48.97 79.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.642 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.739 ' O ' HG23 ' A' ' 38' ' ' VAL . 66.3 t80 -51.88 -43.27 63.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.791 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.6 ttm-85 -77.16 -26.58 53.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.0 m -64.79 -46.83 80.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.771 -179.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.526 HG23 ' N ' ' A' ' 38' ' ' VAL . 26.6 m -76.23 -44.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 34' ' ' TYR . 24.6 t -46.61 -43.33 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.207 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.0 p -58.61 -35.09 71.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.029 0.443 . . . . 0.0 110.506 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 44' ' ' ASP . 95.6 m -85.82 -45.22 11.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.723 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' C ' ' H ' ' A' ' 43' ' ' GLN . 4.4 mm? -63.21 -45.73 90.31 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.039 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 38' ' ' VAL . 2.8 p -68.67 3.99 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.294 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 41' ' ' LEU . 57.1 tt0 -129.28 -23.34 2.98 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.255 -179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 40' ' ' THR . 23.4 t0 -57.79 121.88 11.54 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.25 0.548 . . . . 0.0 110.035 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.452 ' C ' ' O ' ' A' ' 44' ' ' ASP . 11.2 pt20 31.58 89.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.281 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.23 45.71 0.47 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.393 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -59.17 -31.37 68.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.388 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 5.8 ttmt -165.79 131.21 2.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.228 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -50.04 -32.1 14.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.404 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.508 ' N ' HD22 ' B' ' 49' ' ' ASN . . . -72.42 -48.72 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.386 0.612 . . . . 0.0 110.601 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.1 t -49.13 -42.42 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.751 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.402 ' H ' HG22 ' A' ' 52' ' ' VAL . 25.6 m -75.44 -36.36 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.209 0.528 . . . . 0.0 110.295 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -35.82 82.19 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.471 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 59.3 mttp -53.26 -41.98 66.04 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.301 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -65.26 -36.66 84.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.321 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 41.2 mm -66.84 -51.67 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.738 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 77.6 mt-30 -55.37 -40.26 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.348 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.471 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 38.1 m80 -75.73 -40.05 56.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.546 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.4 HD23 ' CE1' ' A' ' 34' ' ' TYR . 62.2 tp -51.51 -30.89 21.87 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.742 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 11.6 p-10 -52.88 -28.4 22.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.38 0.609 . . . . 0.0 110.624 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.549 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.7 pt-20 -57.93 -36.66 72.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.366 -179.448 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -71.6 -53.82 12.47 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.4 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.441 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.95 -41.36 33.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.208 -179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.441 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 39.5 m-80 -68.09 -41.64 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -65.53 -34.81 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.433 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 62' ' ' ALA . 89.7 t -60.78 -62.31 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.513 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -60.71 -51.86 67.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.349 -0.54 . . . . 0.0 111.148 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 -55.43 -11.86 0.95 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.179 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.83 -28.41 6.62 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.693 0.282 . . . . 0.0 110.638 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.411 0 CA-C-O 120.695 0.283 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.713 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 25.3 t -58.81 -48.58 96.56 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.257 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.713 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 7.4 Cg_endo -47.5 -25.76 5.55 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.969 1.779 . . . . 0.0 112.077 -179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.45 -41.23 98.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.217 0.532 . . . . 0.0 110.449 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.434 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.5 m-85 -59.36 -40.65 87.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.253 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.3 mt -70.04 -43.47 79.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.306 0.574 . . . . 0.0 110.501 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -50.63 -28.78 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.542 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -73.25 -33.28 65.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.034 0.445 . . . . 0.0 110.483 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.431 HD13 ' CG2' ' B' ' 66' ' ' VAL . 25.7 mt -72.0 -38.95 69.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.545 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -56.74 -38.61 72.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.191 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.435 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.7 tt0 -66.98 -35.81 80.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.533 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -63.22 -51.86 64.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.949 0.404 . . . . 0.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.438 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.8 pt -72.53 -44.42 61.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.787 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' GLU . . . . . 0.438 ' N ' HG13 ' B' ' 18' ' ' ILE . 83.2 tt0 -68.85 -53.98 18.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.435 ' N ' ' O ' ' B' ' 16' ' ' GLN . 11.2 tpp -86.75 -153.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.196 0.522 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -162.27 36.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.515 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -46.06 -63.16 1.05 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.995 0.426 . . . . 0.0 110.637 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -172.41 65.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.48 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 19.1 tp10 -154.92 -131.33 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.025 0.44 . . . . 0.0 110.359 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -160.37 -173.86 4.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.343 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -74.35 -106.36 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.604 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.562 ' C ' ' H ' ' B' ' 29' ' ' ALA . 19.0 mt -66.0 -33.49 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -64.01 8.67 0.09 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.859 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' ALA . . . . . 0.562 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.46 -43.56 31.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.742 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.417 ' CG ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -58.82 -46.86 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.058 -179.749 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -51.99 -48.75 64.27 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.393 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 65.7 p -67.78 -55.68 12.13 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.907 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.622 ' CE2' HG21 ' B' ' 37' ' ' VAL . 86.2 t80 -56.78 -47.49 80.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.596 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -58.16 -44.2 87.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.936 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -61.97 -35.46 78.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.281 0.563 . . . . 0.0 110.788 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.2 p -73.92 -44.25 55.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.66 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.622 HG21 ' CE2' ' B' ' 33' ' ' TYR . 50.0 t -69.96 -57.1 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.619 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.475 HG13 ' N ' ' B' ' 39' ' ' SER . 5.8 p -48.61 -41.52 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.033 0.444 . . . . 0.0 110.396 -179.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.475 ' N ' HG13 ' B' ' 38' ' ' VAL . 42.6 t -64.67 -38.17 90.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.265 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 44' ' ' ASP . 89.0 m -71.95 -44.06 64.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.385 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.66 -44.04 80.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -73.37 -32.4 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -77.65 -35.11 52.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.218 0.532 . . . . 0.0 110.61 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 40' ' ' THR . 98.8 m-20 -39.12 -68.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -174.53 139.67 0.58 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.556 ' N ' HD12 ' B' ' 46' ' ' LEU . 9.5 mp -96.04 48.32 1.11 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.341 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -61.56 -36.01 79.4 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.004 0.43 . . . . 0.0 110.6 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.527 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -166.61 128.48 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.62 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 49' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 24.4 p30 -47.91 -34.65 9.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.572 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.527 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -65.79 -49.59 67.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.007 0.432 . . . . 0.0 110.813 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' B' ' 54' ' ' LYS . 22.4 t -50.96 -43.98 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.71 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.2 m -80.68 -37.28 16.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.119 0.485 . . . . 0.0 110.65 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.15 -47.34 83.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.938 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.461 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.7 pttp -54.16 -41.29 68.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.579 0.704 . . . . 0.0 110.27 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.461 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 27.2 mmt180 -65.35 -37.91 88.48 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.136 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 6.0 mm -66.17 -48.56 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.684 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -56.18 -41.86 76.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.405 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -69.17 -38.9 78.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.384 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' LEU . . . . . 0.548 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.9 OUTLIER -53.83 -36.32 62.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.572 -178.894 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -53.82 -27.43 29.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.438 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -64.51 -37.95 89.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.452 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.6 -53.65 10.0 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.404 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -51.34 -39.63 57.43 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.056 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 64' ' ' ASN . . . . . 0.453 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 49.7 t30 -71.02 -38.17 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.251 -178.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 43.0 mmtt -59.66 -32.13 70.19 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.438 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.431 ' CG2' HD13 ' B' ' 14' ' ' LEU . 98.7 t -64.67 -60.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.46 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -67.83 -45.13 75.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.372 0.606 . . . . 0.0 110.985 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -54.55 -23.21 15.68 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.313 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.89 -7.63 70.55 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.29 0.567 . . . . 0.0 110.37 179.8 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 29.8 t . . . . . 0 CA--C 1.532 0.271 0 CA-C-O 120.935 0.398 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.538 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.6 t -51.71 -55.63 28.23 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.6 178.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 28.1 Cg_exo -36.12 -26.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.353 2.035 . . . . 0.0 112.479 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 7' ' ' VAL . 88.4 t80 -60.7 -43.11 98.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.394 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.433 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -56.46 -47.99 78.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.55 -45.09 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.415 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -51.65 -25.19 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.672 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.32 -36.4 74.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 110.48 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.615 ' N ' HD12 ' A' ' 14' ' ' LEU . 8.3 mp -68.41 -37.75 80.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.33 -39.35 86.77 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.259 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -55.23 -26.6 40.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.619 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -73.74 -53.74 9.66 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.849 -179.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -71.54 -42.89 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.493 0.664 . . . . 0.0 110.878 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.439 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 79.4 mm-40 -62.17 -53.03 61.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.179 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.3 mtt -103.05 -141.07 0.36 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.088 0.471 . . . . 0.0 110.081 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -169.84 56.5 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -51.61 63.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.193 0.52 . . . . 0.0 110.613 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 t 179.38 73.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.211 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.447 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 6.3 tp10 -164.6 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.995 0.426 . . . . 0.0 110.397 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -149.66 -172.18 4.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.46 0.648 . . . . 0.0 110.213 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 18' ' ' ILE . 59.7 tttp -79.75 -108.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.615 ' O ' ' SD ' ' A' ' 30' ' ' MET . 20.0 tt -61.52 -37.52 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.422 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.3 m-70 -69.56 20.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.067 0.46 . . . . 0.0 111.018 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.552 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -73.9 -45.91 47.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.615 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -59.66 -38.97 82.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.376 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.56 ' N ' ' SD ' ' A' ' 30' ' ' MET . 18.5 m120 -51.4 -44.96 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.272 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.447 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 6.8 t -73.32 -54.5 8.21 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.813 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.477 ' CD1' HD11 ' A' ' 14' ' ' LEU . 64.7 t80 -59.62 -50.66 73.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.542 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.1 t80 -54.9 -40.8 70.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.818 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.3 ttt-85 -72.33 -27.15 62.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.848 0.356 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -70.59 -44.37 67.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.404 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.518 ' O ' ' N ' ' A' ' 41' ' ' LEU . 59.3 t -66.09 -63.82 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.791 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.212 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 42' ' ' VAL . 26.3 m -47.18 -43.7 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.965 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.546 ' N ' HG23 ' A' ' 38' ' ' VAL . 11.5 t -53.27 -59.1 4.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 m -77.73 -41.55 37.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.993 0.902 . . . . 0.0 111.277 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 37' ' ' VAL . 40.7 tp -55.17 -41.34 71.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 38' ' ' VAL . 55.0 t -68.25 -3.85 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 120.912 0.387 . . . . 0.0 110.173 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.555 ' O ' ' C ' ' A' ' 44' ' ' ASP . 11.3 tp-100 -113.07 -29.56 7.28 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.035 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.555 ' C ' ' O ' ' A' ' 43' ' ' GLN . 46.7 t0 -17.81 -78.92 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.188 0.518 . . . . 0.0 111.341 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.421 ' O ' ' C ' ' A' ' 46' ' ' LEU . 27.5 pt20 -142.89 0.5 1.23 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.554 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' A' ' 45' ' ' GLN . 5.5 tp 34.18 50.39 0.36 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.099 0.476 . . . . 0.0 110.722 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -56.21 -28.49 58.51 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.606 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.529 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 62.2 tttp -178.66 143.92 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.324 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -57.71 -38.82 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.694 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.529 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -68.44 -49.88 56.69 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.75 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 t -51.15 -65.08 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.08 -31.95 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.275 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.52 -42.52 98.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.101 0.476 . . . . 0.0 110.402 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -59.99 -40.28 88.61 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.134 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -66.63 -39.45 88.29 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.317 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.25 -48.88 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.66 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -57.15 -33.02 66.98 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.134 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 4.6 t-80 -74.54 -40.49 61.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.027 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.2 -29.24 63.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.067 0.46 . . . . 0.0 110.532 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -51.38 -30.65 19.63 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.75 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 7.5 pt-20 -60.72 -28.97 69.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.21 -59.67 2.74 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.368 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -42.98 66.71 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.348 0.594 . . . . 0.0 110.218 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -62.69 -39.02 92.66 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.2 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -63.6 -38.53 91.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.502 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.04 -50.89 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-O 121.336 0.588 . . . . 0.0 110.355 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.88 -47.31 78.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.689 0.757 . . . . 0.0 111.304 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -56.16 -18.38 9.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.071 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.44 -18.41 52.62 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 . . . . . 0 C--N 1.33 -0.28 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.938 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.44 -0.963 0 CA-C-O 120.689 0.28 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 67.1 t -55.37 -49.86 90.07 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.826 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 6.7 Cg_endo -46.7 -20.6 1.1 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.831 1.687 . . . . 0.0 112.296 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -60.17 -42.54 95.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.151 0.501 . . . . 0.0 110.489 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' PHE . . . . . 0.456 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.5 m-85 -58.52 -41.97 86.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.407 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 64.6 mt -67.65 -44.23 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 121.533 0.682 . . . . 0.0 110.464 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -51.61 -30.61 21.84 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.629 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.53 -32.05 70.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.115 0.483 . . . . 0.0 110.408 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.67 -39.35 70.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.293 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -55.85 -32.1 63.33 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.095 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.25 -30.61 68.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.522 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -67.87 -50.54 55.86 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 pt -72.73 -35.86 51.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 110.773 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -70.94 -54.34 11.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.43 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 28.8 ttp -99.03 -62.5 1.23 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.441 HD21 ' HA ' ' B' ' 25' ' ' ASP . 11.1 t-20 78.6 49.81 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.244 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -51.06 -41.34 59.85 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 110.844 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -165.44 65.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.235 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -154.43 -131.97 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.179 0.514 . . . . 0.0 110.405 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ASP . . . . . 0.441 ' HA ' HD21 ' B' ' 21' ' ' ASN . 69.1 m-20 -151.93 -175.59 5.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.46 0.648 . . . . 0.0 109.996 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -80.02 -104.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.95 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.641 HD11 ' HD2' ' B' ' 67' ' ' LYS . 15.8 tt -63.11 -37.12 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.243 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -63.13 -3.52 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.477 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.54 -46.52 83.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.407 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -63.96 -43.17 96.59 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.176 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.574 ' N ' ' SD ' ' B' ' 30' ' ' MET . 22.5 t-20 -52.48 -53.65 42.91 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.769 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 8.3 t -64.22 -53.51 48.11 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.823 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.456 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -59.22 -49.44 77.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.459 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.3 t80 -56.92 -47.24 81.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.821 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -65.06 -31.35 72.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.507 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.4 t -68.8 -42.85 76.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.646 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.11 -63.68 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.764 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.556 HG23 ' N ' ' B' ' 39' ' ' SER . 26.7 m -48.83 -44.46 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.41 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' SER . . . . . 0.556 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.9 p -60.7 -40.23 91.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.412 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 96.7 m -69.4 -46.76 66.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.121 0.486 . . . . 0.0 110.677 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' B' ' 44' ' ' ASP . 93.3 mt -60.35 -30.06 69.3 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.409 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -89.16 -39.69 12.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.154 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -69.38 -13.66 62.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 45' ' ' GLN . 71.8 m-20 -146.45 166.74 25.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.346 0.593 . . . . 0.0 109.564 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 15.5 tt0 79.22 -77.99 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.71 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 24.6 mt 41.11 37.88 0.64 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.017 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.1 t -72.34 -32.22 66.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.421 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.6 tttt -170.41 132.2 0.98 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.611 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.23 -40.67 59.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.786 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.421 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -62.9 -44.49 95.97 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.824 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.46 -44.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.569 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.462 HG23 ' N ' ' B' ' 53' ' ' LEU . 28.5 m -79.22 -44.96 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.246 0.546 . . . . 0.0 110.683 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.462 ' N ' HG23 ' B' ' 52' ' ' VAL . 58.4 tp -57.06 -57.02 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.823 -178.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 0.2 OUTLIER -50.9 -34.59 29.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.257 0.551 . . . . 0.0 110.502 -179.309 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt85 -71.81 -41.87 67.74 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.978 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.3 -53.42 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.523 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -58.19 -37.8 75.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.473 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 4.4 m-70 -73.41 -38.95 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.38 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 40.7 tp -55.64 -30.11 60.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.567 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -52.33 -28.28 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -59.62 -32.27 70.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.571 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -55.61 7.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.521 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -42.67 62.32 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.265 0.555 . . . . 0.0 110.397 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -63.92 -39.65 94.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.415 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.84 -38.25 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.468 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.8 t -62.14 -47.93 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' B' ' 27' ' ' ILE . 0.0 OUTLIER -66.04 -40.79 91.26 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 122.014 0.911 . . . . 0.0 111.296 -179.278 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -49.8 -25.79 3.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.312 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.84 -20.38 55.93 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' B' ' 67' ' ' LYS . 55.4 mm-40 . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 0.0 110.057 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 120.612 0.244 . . . . 0.0 110.64 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.569 ' O ' ' N ' ' A' ' 9' ' ' TYR . 2.6 t -53.69 -55.21 37.77 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.043 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 77.6 Cg_exo -34.94 -25.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.391 2.06 . . . . 0.0 112.933 -179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.569 ' N ' ' O ' ' A' ' 7' ' ' VAL . 82.9 t80 -56.37 -40.16 74.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -61.82 -45.66 92.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.563 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.11 -43.68 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.427 0.632 . . . . 0.0 110.552 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -48.63 -23.74 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.397 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -74.18 -35.33 63.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.172 0.511 . . . . 0.0 110.632 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.1 mt -68.28 -39.41 82.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.574 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -57.88 -40.09 79.43 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.595 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -65.95 -31.04 71.72 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -67.15 -52.39 42.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.093 0.473 . . . . 0.0 110.97 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 11.8 pt -72.82 -42.86 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.576 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 52.1 tp10 -62.07 -54.41 41.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.432 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 44.1 mtt -99.34 -139.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -170.3 49.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.232 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -58.12 -45.52 87.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.494 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 m 174.5 72.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.325 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.76 -136.77 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.115 0.483 . . . . 0.0 110.301 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -145.18 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.307 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -96.18 -108.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.357 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.599 ' O ' ' SD ' ' A' ' 30' ' ' MET . 10.3 tp -55.85 -36.75 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.01 0.433 . . . . 0.0 110.52 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.402 ' N ' HG23 ' A' ' 27' ' ' ILE . 56.2 m80 -81.42 20.51 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.526 -179.681 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.72 -52.8 26.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.49 . . . . 0.0 110.754 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.599 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.88 -32.92 72.34 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.249 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.52 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 51.3 t30 -51.68 -48.79 63.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.472 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.6 t -67.9 -52.88 31.27 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.744 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -60.67 -48.06 83.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.325 0.583 . . . . 0.0 110.936 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.576 ' CE1' HG21 ' A' ' 38' ' ' VAL . 54.4 t80 -55.18 -54.81 38.64 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.997 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.34 -35.63 76.1 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.438 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.5 t -63.04 -44.64 95.33 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.392 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.83 -56.6 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.5 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.576 HG21 ' CE1' ' A' ' 34' ' ' TYR . 90.5 t -54.79 -49.09 71.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.36 -178.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -60.34 -45.22 94.21 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.307 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 78.3 m -61.13 -48.78 80.03 Favored 'General case' 0 C--N 1.328 -0.37 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.544 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.86 -41.27 91.87 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.15 0.5 . . . . 0.0 110.743 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 42' ' ' VAL . 60.2 t -86.16 26.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.23 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -162.32 10.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -151.15 17.98 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.186 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -147.79 -79.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.669 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.9 mt 48.46 45.75 20.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.856 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -85.61 -27.15 25.64 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.465 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 tptm -173.02 132.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.975 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.44 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 76.2 m-20 -51.19 -45.79 61.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.513 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.6 -46.79 88.92 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.968 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.4 t -56.32 -46.3 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.084 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.573 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.3 m -78.48 -49.92 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-O 121.736 0.779 . . . . 0.0 110.333 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.6 ' C ' HD23 ' A' ' 53' ' ' LEU . 9.0 tt -52.77 -59.97 3.83 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.937 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -49.22 -34.77 15.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.342 0.592 . . . . 0.0 110.196 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.2 -38.77 91.5 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.962 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 52' ' ' VAL . 16.3 mm -65.52 -51.03 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.449 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -58.85 -40.7 85.06 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.506 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -72.62 -47.63 46.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.144 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.4 ' N ' ' ND1' ' A' ' 58' ' ' HIS . 37.6 tp -55.89 -33.69 64.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -56.76 -34.7 67.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.151 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.509 ' O ' ' ND2' ' A' ' 64' ' ' ASN . 4.7 pt-20 -52.84 -30.49 33.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.335 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.82 -42.0 35.22 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.553 0.692 . . . . 0.0 110.909 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.1 OUTLIER -56.17 -47.49 78.15 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.163 -179.471 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . 0.517 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 0.7 OUTLIER -73.4 -22.59 60.21 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.003 0.43 . . . . 0.0 110.199 -179.246 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.22 -47.53 70.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.619 0.723 . . . . 0.0 111.348 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 63' ' ' TYR . 0.8 OUTLIER -56.77 -40.79 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.12 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.429 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 21.1 mtmt -67.86 -45.89 73.27 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.015 0.912 . . . . 0.0 111.127 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.66 -32.24 63.06 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.963 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.83 -14.28 79.9 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 . . . . . 0 N--CA 1.469 0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.42 179.818 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--O 1.232 0.132 0 CA-C-O 121.312 0.577 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.589 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.2 t -67.01 -39.86 24.95 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.135 178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.589 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 76.7 Cg_exo -50.42 -26.75 16.82 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.89 1.727 . . . . 0.0 112.154 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.6 -40.76 92.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.426 0.631 . . . . 0.0 110.517 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.76 -41.78 87.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.487 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 56.2 mt -67.44 -44.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 CA-C-O 121.292 0.568 . . . . 0.0 110.267 -179.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -49.18 -27.67 3.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.59 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 61.6 t-20 -74.23 -35.11 63.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.593 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -57.29 -40.17 77.22 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.09 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -65.8 -35.91 82.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.282 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' HIS . . . . . 0.439 ' O ' ' OD1' ' B' ' 21' ' ' ASN . 7.5 m-70 -65.96 -48.74 70.32 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.561 -0.455 . . . . 0.0 110.742 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -74.77 -33.12 30.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.0 110.694 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.19 -56.61 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.073 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' MET . . . . . 0.436 ' C ' ' ND2' ' B' ' 21' ' ' ASN . 47.6 mtt -87.28 -56.27 3.44 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.998 0.428 . . . . 0.0 110.617 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 21' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' B' ' 17' ' ' HIS . 3.7 m-80 73.58 46.19 0.22 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.026 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -39.95 -64.54 0.48 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.127 0.489 . . . . 0.0 111.02 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -140.62 3.44 1.88 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.768 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -86.99 -131.85 0.06 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.125 0.488 . . . . 0.0 110.335 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -156.43 -158.13 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.336 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -95.47 -101.87 0.16 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.514 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' ILE . . . . . 0.401 HD11 ' OE1' ' B' ' 70' ' ' GLU . 44.3 mm -62.64 -37.26 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.43 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -69.89 2.55 3.34 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.536 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -50.36 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.038 0.447 . . . . 0.0 111.087 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.562 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.11 -42.61 99.4 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.995 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.562 ' N ' ' SD ' ' B' ' 30' ' ' MET . 13.8 t-20 -50.6 -51.52 47.76 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.523 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 70.3 p -63.63 -51.56 64.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.591 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 43.2 t80 -65.09 -20.4 66.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 34' ' ' TYR . . . . . 0.675 ' O ' HG23 ' B' ' 38' ' ' VAL . 52.9 t80 -72.97 -53.87 10.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.062 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' CZ ' ' A' ' 34' ' ' TYR . 19.7 mmm180 -72.51 -18.32 61.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.821 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.0 t -68.92 -51.64 37.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.947 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' VAL . . . . . 0.527 HG23 ' N ' ' B' ' 38' ' ' VAL . 10.2 m -77.4 -44.72 30.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.675 HG23 ' O ' ' B' ' 34' ' ' TYR . 71.0 t -53.71 -49.45 57.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.382 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 36.8 t -64.44 -25.74 68.14 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.864 0.364 . . . . 0.0 110.348 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' THR . . . . . 0.546 ' O ' ' N ' ' B' ' 44' ' ' ASP . 35.5 m -83.13 -50.52 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.554 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.561 HD22 ' CZ ' ' B' ' 55' ' ' ARG . 96.8 mt -63.02 -42.24 99.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.921 0.391 . . . . 0.0 110.827 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.5 t -68.47 -17.7 22.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.415 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -108.0 -19.25 13.57 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.048 0.451 . . . . 0.0 110.794 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' B' ' 40' ' ' THR . 37.6 t70 -90.5 -25.54 20.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.394 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -117.62 160.56 21.08 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.308 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -168.74 31.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.9 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 69.1 m -67.09 -41.19 86.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 110.902 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.487 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -174.08 142.93 0.88 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.265 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -51.49 -34.85 37.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.741 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' ALA . . . . . 0.487 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -75.51 -50.97 14.08 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.858 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -50.67 -43.23 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.698 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' VAL . . . . . 0.422 HG23 ' N ' ' B' ' 53' ' ' LEU . 23.0 m -75.15 -38.01 41.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.07 0.462 . . . . 0.0 110.285 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' LEU . . . . . 0.422 ' N ' HG23 ' B' ' 52' ' ' VAL . 65.7 tp -57.97 -36.27 72.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.573 -179.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' LYS . . . . . 0.417 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 57.6 mtpt -57.33 -41.57 80.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.549 -179.294 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' ARG . . . . . 0.561 ' CZ ' HD22 ' B' ' 41' ' ' LEU . 67.6 mtp180 -65.63 -41.36 92.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.117 0.484 . . . . 0.0 110.449 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 21.9 mm -65.33 -50.5 72.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.856 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -57.53 -39.42 76.56 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.311 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 52.8 m170 -65.85 -44.97 83.86 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.161 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.7 tp -53.57 -27.78 28.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.099 0.476 . . . . 0.0 111.016 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -52.52 -36.7 55.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.94 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.78 -31.66 71.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.477 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.98 -58.88 4.09 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.124 0.488 . . . . 0.0 110.813 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -40.19 61.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.353 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -66.66 -39.06 88.03 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.595 0.712 . . . . 0.0 110.319 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.7 mmtp -62.67 -36.8 84.06 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.305 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.4 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 82.2 t -63.8 -42.15 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-O 121.378 0.608 . . . . 0.0 110.264 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -67.18 -45.12 77.92 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.693 0.759 . . . . 0.0 111.488 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 51.7 ttt85 -88.71 1.49 55.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.103 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -108.67 -34.37 2.65 Favored Glycine 0 N--CA 1.474 1.226 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.401 ' OE1' HD11 ' B' ' 27' ' ' ILE . 1.5 pp20? . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.549 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.5 p -74.21 97.21 2.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.443 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' C ' ' H ' ' A' ' 5' ' ' PHE . 15.6 pt-20 -169.47 142.55 2.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.64 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.5 mt 58.08 7.78 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.437 ' CE2' ' OG ' ' A' ' 6' ' ' SER . 51.2 p90 -68.77 -34.45 75.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' CE2' ' A' ' 5' ' ' PHE . 0.9 OUTLIER -75.39 132.17 40.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.217 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -67.52 -41.63 32.46 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.943 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 59.1 Cg_exo -49.58 -24.84 9.96 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 C-N-CA 121.727 1.618 . . . . 0.0 111.915 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.59 -40.92 89.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.022 0.439 . . . . 0.0 110.362 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.6 m-85 -59.31 -42.38 91.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.232 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -65.88 -43.93 92.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.025 0.441 . . . . 0.0 110.421 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -50.84 -29.74 12.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.55 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -69.87 -35.73 74.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 110.57 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.431 HD21 ' CD1' ' A' ' 33' ' ' TYR . 42.2 mt -67.36 -38.53 84.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.693 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -55.91 -36.22 67.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -69.4 -36.69 76.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.5 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -60.88 -50.86 71.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 19' ' ' GLU . 14.1 pt -72.07 -43.65 66.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.155 0.502 . . . . 0.0 110.942 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 18' ' ' ILE . 50.5 tp10 -66.53 -51.74 53.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.391 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.1 mtt -104.51 -157.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 0.0 109.856 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' SER . 61.4 t30 -142.77 62.58 1.4 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.455 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 23' ' ' SER . 39.9 tp60 -73.01 39.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.528 0.68 . . . . 0.0 110.87 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' ASN . 5.0 p 75.76 50.86 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.402 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 12.6 tp10 -143.62 -137.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.718 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -151.78 -164.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.373 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -84.25 -105.42 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.467 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.435 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.3 mt -62.21 -41.79 92.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -57.61 -6.03 0.44 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.457 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -61.2 -45.12 95.89 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.185 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.6 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -63.42 -45.46 90.85 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.216 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.587 ' N ' ' SD ' ' A' ' 30' ' ' MET . 55.4 t30 -53.47 -49.72 66.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.047 -0.661 . . . . 0.0 110.65 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 77.0 p -63.33 -50.39 70.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.03 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.431 ' CD1' HD21 ' A' ' 14' ' ' LEU . 48.2 t80 -69.33 -22.07 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.746 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 30' ' ' MET . 40.2 t80 -74.81 -56.65 4.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.304 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -60.22 -25.25 65.48 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 120.984 0.421 . . . . 0.0 110.325 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.8 t -72.31 -45.99 57.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.865 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -66.68 -63.03 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.494 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.486 HG23 ' N ' ' A' ' 39' ' ' SER . 20.0 m -46.33 -40.49 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.523 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.486 ' N ' HG23 ' A' ' 38' ' ' VAL . 37.6 m -59.2 -39.64 83.29 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.2 m -74.42 -44.56 51.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.572 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.446 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 91.0 mt -56.51 -22.93 36.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.604 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.8 t -92.32 -28.34 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.594 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -90.37 -38.33 13.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.39 0.614 . . . . 0.0 110.813 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.451 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 26.2 p-10 -42.55 -59.4 1.9 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.986 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.438 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 13.3 pt20 -167.76 124.21 1.1 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.557 0.694 . . . . 0.0 110.395 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mp -94.7 51.72 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.378 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t -60.37 -31.33 70.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.221 0.534 . . . . 0.0 110.374 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -169.65 128.1 0.94 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.0 p30 -49.31 -33.3 12.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.179 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -71.93 -49.37 38.23 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.785 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.1 t -46.9 -38.68 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.37 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.21 -34.56 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.267 0.556 . . . . 0.0 111.099 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.457 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.82 -46.46 87.84 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.026 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -40.44 94.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.008 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.445 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 75.3 mtp180 -65.98 -39.79 90.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.283 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 86.6 mt -66.27 -46.24 87.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -58.1 -34.95 70.74 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 -69.82 -42.21 73.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.16 -29.49 45.71 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.549 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -52.62 -29.91 28.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.543 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -63.45 -32.95 74.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.142 0.496 . . . . 0.0 110.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.41 -58.1 4.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.765 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.529 ' OH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -52.02 -43.41 63.69 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 110.071 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -64.29 -33.73 76.49 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.386 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -64.2 -39.22 93.53 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.575 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.25 -51.33 72.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.394 0.616 . . . . 0.0 110.435 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -65.32 -45.97 82.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.842 0.829 . . . . 0.0 111.333 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -54.42 -25.42 24.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.127 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.12 -12.72 82.96 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -87.4 -164.9 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 0.0 110.408 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.0 p -148.4 54.11 1.01 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.811 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 57.85 22.15 8.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.233 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.86 98.51 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.353 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -179.14 43.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.438 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 64.22 81.03 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -54.8 123.42 13.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.001 0.429 . . . . 0.0 110.416 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.457 ' O ' ' CG ' ' A' ' 77' ' ' HIS . 53.3 t-80 -84.74 23.53 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.444 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 54.39 77.84 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.625 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -149.96 139.99 22.02 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.682 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.532 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.52 ' SD ' ' N ' ' B' ' 1' ' ' MET . 1.9 mpt? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -79.0 -54.25 6.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.313 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 50.75 91.43 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.112 0.482 . . . . 0.0 110.601 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.459 ' C ' ' H ' ' B' ' 6' ' ' SER . 1.5 tp -168.91 -158.23 0.2 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.221 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 48.4 t80 68.85 -44.01 0.52 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.648 0.737 . . . . 0.0 110.491 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.459 ' H ' ' C ' ' B' ' 4' ' ' LEU . 1.4 m -64.88 130.77 44.68 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.417 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.621 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 74.4 t -57.49 -49.72 92.23 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.971 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 8.7 Cg_endo -47.44 -23.81 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.349 1.366 . . . . 0.0 112.279 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -63.62 -42.56 98.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.089 0.471 . . . . 0.0 110.651 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.423 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.71 -43.91 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.366 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 67.5 mt -69.18 -44.01 81.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.2 0.524 . . . . 0.0 110.569 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -50.72 -26.78 5.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.337 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -72.67 -31.79 65.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.893 0.378 . . . . 0.0 110.278 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.98 -36.17 69.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.529 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -55.82 -39.37 71.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.989 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -65.64 -36.39 83.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -62.84 -51.41 67.14 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.635 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.6 pt -73.02 -43.2 59.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.087 0.47 . . . . 0.0 110.811 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -64.97 -55.2 20.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.687 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 42.7 mtt -98.05 -145.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 p30 -170.63 46.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.153 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.01 -44.72 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.554 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 m -179.97 69.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.148 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -165.08 -134.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.32 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -156.94 -167.44 2.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.346 0.593 . . . . 0.0 110.014 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -83.23 -106.07 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.585 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.461 ' C ' ' H ' ' B' ' 29' ' ' ALA . 21.3 tt -63.0 -34.57 67.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -67.59 8.09 0.4 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.779 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.48 -45.25 39.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.679 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.419 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -60.9 -46.67 89.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.834 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.79 -46.14 67.49 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.516 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -67.56 -54.17 22.21 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.835 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.423 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -61.76 -46.17 90.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.252 0.548 . . . . 0.0 110.669 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.601 ' O ' HG23 ' B' ' 38' ' ' VAL . 68.5 t80 -55.98 -47.11 78.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.741 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.529 ' NH2' ' OH ' ' A' ' 63' ' ' TYR . 76.0 ttt180 -66.16 -34.22 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -62.33 -45.01 95.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 110.649 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 85.5 t -69.26 -44.87 80.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.501 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.601 HG23 ' O ' ' B' ' 34' ' ' TYR . 65.5 t -51.25 -48.19 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.434 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 78.4 p -56.39 -43.05 78.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.473 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' THR . . . . . 0.43 ' O ' ' N ' ' B' ' 44' ' ' ASP . 95.8 m -64.38 -44.62 90.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.674 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 93.1 mt -60.85 -47.29 87.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.508 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.11 -40.84 86.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 110.369 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.483 ' O ' ' C ' ' B' ' 44' ' ' ASP . 94.8 mt-30 -72.97 -32.39 65.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.151 0.5 . . . . 0.0 110.655 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 43' ' ' GLN . 67.0 t0 -28.5 -84.2 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.147 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.51 ' O ' ' N ' ' B' ' 47' ' ' THR . 26.5 pt20 -162.78 9.76 0.06 Allowed 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.47 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' B' ' 45' ' ' GLN . 1.1 tt 26.03 42.0 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.031 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.51 ' N ' ' O ' ' B' ' 45' ' ' GLN . 5.2 t -60.05 -33.01 71.47 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.447 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -154.32 127.43 8.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.592 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -47.45 -33.53 6.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.9 -50.22 57.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.2 t -50.79 -46.46 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.318 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -76.22 -39.93 35.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.378 0.608 . . . . 0.0 111.406 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -66.56 -40.56 89.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.896 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -58.18 -44.87 88.24 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.172 -178.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -65.62 -34.94 79.39 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.977 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.2 mm -69.08 -48.19 70.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.419 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -59.58 -43.5 93.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.128 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -69.86 -45.48 67.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.441 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.404 HD23 ' CE1' ' B' ' 34' ' ' TYR . 51.2 tp -51.57 -28.68 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.03 -29.37 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.394 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.02 -35.5 73.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.61 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.04 -49.39 37.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.773 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -55.48 -42.06 73.84 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.452 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 2.4 t-20 -68.56 -36.84 79.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.281 0.562 . . . . 0.0 110.854 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -60.33 -41.37 93.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.46 -47.85 79.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.67 0.748 . . . . 0.0 110.608 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -44.61 94.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.926 0.87 . . . . 0.0 111.381 -179.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 42.6 ttm180 -63.74 -21.14 66.26 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.964 -179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.48 -20.21 14.0 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -100.79 -5.7 25.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.666 0.269 . . . . 0.0 110.613 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 92.9 p -43.16 158.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.441 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -58.62 -53.79 54.33 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.451 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 11.3 mt -76.82 134.15 39.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.653 0.74 . . . . 0.0 110.43 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -143.74 153.79 42.79 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.508 1.147 . . . . 0.0 109.701 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -146.49 127.66 14.73 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.745 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.533 ' CG ' ' N ' ' B' ' 77' ' ' HIS . 38.9 t-80 -169.76 -116.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.645 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.533 ' N ' ' CG ' ' B' ' 76' ' ' HIS . 78.3 t60 -159.86 5.93 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.343 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 51.56 -172.91 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.617 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -158.07 139.26 13.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.574 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.48 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.4 m -61.52 -40.23 93.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 56.75 71.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.395 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.656 HD12 ' N ' ' A' ' 4' ' ' LEU . 6.3 mp 50.38 -125.79 2.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.155 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.8 t80 59.25 -69.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.026 0.441 . . . . 0.0 110.59 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.587 ' N ' ' O ' ' A' ' 4' ' ' LEU . 0.3 OUTLIER -63.18 130.92 46.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.042 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.602 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.6 t -67.31 -39.3 19.77 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.051 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 60.7 Cg_exo -53.08 -25.97 30.88 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 121.834 1.689 . . . . 0.0 111.951 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -60.18 -43.19 96.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 0.0 110.422 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.3 m-85 -57.08 -40.46 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.08 -44.2 84.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.09 0.472 . . . . 0.0 110.352 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -51.13 -30.75 17.41 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.614 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -69.08 -32.07 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.501 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.21 -38.63 66.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.4 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -56.09 -34.01 65.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.105 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -67.77 -33.42 74.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.402 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -65.35 -51.42 60.63 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.785 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.16 -40.07 65.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.321 0.581 . . . . 0.0 110.782 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -67.83 -53.78 24.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.136 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.419 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 44.7 mtt -98.74 -65.0 0.99 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.091 0.472 . . . . 0.0 110.086 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 21.0 t30 80.99 47.91 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.878 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -53.27 -40.76 64.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.299 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.2 p -158.87 64.91 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -161.89 -132.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.334 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 64.5 m-20 -158.66 -172.03 3.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.36 0.6 . . . . 0.0 110.062 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -77.73 -104.62 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.593 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.555 ' C ' ' H ' ' A' ' 29' ' ' ALA . 16.2 tt -63.97 -36.02 75.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.046 0.451 . . . . 0.0 110.768 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -68.05 16.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.92 -44.99 21.46 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.246 0.546 . . . . 0.0 110.263 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.647 ' O ' ' N ' ' A' ' 34' ' ' TYR . 26.3 tpp -61.9 -48.59 79.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.957 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.495 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 62.6 t-20 -47.28 -53.23 14.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.724 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.1 m -62.1 -50.31 72.43 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.959 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 40.8 t80 -67.2 -21.97 65.75 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.647 ' N ' ' O ' ' A' ' 30' ' ' MET . 45.2 t80 -73.91 -60.33 2.31 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.342 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -61.16 -26.33 67.62 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.922 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -66.23 -47.89 72.33 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.708 0.289 . . . . 0.0 110.491 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.6 -48.06 60.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.422 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.455 HG21 ' CE1' ' A' ' 34' ' ' TYR . 99.2 t -62.46 -53.96 40.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.716 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 m -59.7 -18.39 42.02 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.36 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.0 m -87.51 -49.32 7.27 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.102 0.477 . . . . 0.0 111.078 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' CD1' ' HE ' ' A' ' 55' ' ' ARG . 96.6 mt -70.81 -42.85 69.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.66 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 42' ' ' VAL . 43.4 t -78.3 27.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.401 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 41' ' ' LEU . 74.6 mt-30 -147.61 2.92 0.73 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.729 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 46' ' ' LEU . 38.5 t70 -150.37 168.09 25.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.133 0.492 . . . . 0.0 110.278 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.9 tt0 67.31 -64.86 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.504 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.1 mt 36.96 43.34 0.29 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.332 0.587 . . . . 0.0 111.183 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 t -76.53 -31.85 57.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.425 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -170.82 131.32 0.84 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.645 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -50.07 -37.69 34.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.626 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.87 -48.46 71.47 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.315 0.578 . . . . 0.0 110.555 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -53.39 -44.02 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.628 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.12 -36.63 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-O 121.012 0.434 . . . . 0.0 111.09 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.22 -47.66 83.45 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.71 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 15.5 pttp -50.2 -38.44 40.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.206 0.527 . . . . 0.0 110.21 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.428 ' HE ' ' CD1' ' A' ' 41' ' ' LEU . 15.2 mmm180 -64.55 -38.4 90.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.173 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.01 -51.12 73.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.302 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -53.58 -45.29 69.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.367 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.404 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 2.2 m80 -65.08 -38.28 90.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -54.54 -30.43 53.93 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.172 -178.78 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -61.41 -32.1 72.04 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.036 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -59.31 -40.46 86.32 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.199 0.524 . . . . 0.0 110.844 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.63 -49.27 33.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.237 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -49.75 -43.1 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.944 -179.279 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.562 ' ND2' ' CZ ' ' A' ' 68' ' ' ARG . 48.1 t30 -66.95 -35.84 80.87 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.333 0.587 . . . . 0.0 110.372 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 30.7 tptt -69.61 -41.43 75.72 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.507 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -46.19 96.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 122.12 0.962 . . . . 0.0 110.664 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.461 ' HD3' HD11 ' A' ' 27' ' ' ILE . 26.7 mmtm -66.84 -43.11 84.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.449 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.562 ' CZ ' ' ND2' ' A' ' 64' ' ' ASN . 78.0 mtm180 -81.51 -15.14 55.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.454 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -92.88 -37.76 5.66 Favored Glycine 0 N--CA 1.471 1.012 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.447 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.7 pp20? -73.5 -35.27 65.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.055 0.455 . . . . 0.0 110.378 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.4 m -126.79 114.64 18.22 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.58 0.705 . . . . 0.0 110.472 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -81.0 -13.36 58.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.504 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 mt -72.41 -75.48 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.256 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 46.91 38.59 6.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.0 110.498 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -163.87 133.17 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.524 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -82.47 67.93 8.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.273 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -65.81 -45.97 80.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.623 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -79.8 158.53 26.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.364 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.437 ' O ' ' CG ' ' A' ' 80' ' ' HIS . 98.1 m-70 52.58 -165.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.675 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' A' ' 79' ' ' HIS . 71.3 m80 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 118.092 -0.956 . . . . 0.0 110.484 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ptt? . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 91.0 p -58.68 120.06 8.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.059 0.457 . . . . 0.0 110.505 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -84.75 167.4 16.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.314 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 mt 55.47 22.21 4.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.293 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -60.86 -47.61 85.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.282 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 3.4 m -79.42 119.31 22.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.295 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.503 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -56.44 -45.49 99.92 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.197 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 88.5 Cg_exo -45.78 -23.52 1.64 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.533 1.489 . . . . 0.0 112.615 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.91 -39.96 91.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.354 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -60.36 -42.35 95.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.347 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.33 -45.3 98.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.056 0.455 . . . . 0.0 110.437 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -48.61 -28.38 3.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.577 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 55.9 m-20 -74.37 -39.76 62.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.6 mt -69.49 -46.22 67.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.329 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -62.79 -26.06 68.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.459 0.647 . . . . 0.0 110.519 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -63.45 -29.63 70.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.569 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.573 ' NE2' ' O ' ' B' ' 25' ' ' ASP . 82.8 t60 -81.84 -61.56 1.88 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.258 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.418 ' H ' HG23 ' B' ' 18' ' ' ILE . 2.7 pt -50.5 -37.25 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-O 121.385 0.612 . . . . 0.0 110.359 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -74.14 -55.5 6.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.662 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -101.52 -119.76 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.055 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.448 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 21.2 p-10 -176.42 74.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.258 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -79.89 -72.34 0.41 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.221 0.534 . . . . 0.0 110.245 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 28.5 p -172.99 85.19 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.359 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLU . . . . . 0.441 ' N ' ' CE1' ' B' ' 17' ' ' HIS . 9.4 tp10 -169.73 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.562 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASP . . . . . 0.573 ' O ' ' NE2' ' B' ' 17' ' ' HIS . 91.7 m-20 -135.36 -95.9 0.25 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.741 0.305 . . . . 0.0 110.339 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -163.13 -99.51 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.178 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.93 -40.59 89.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.131 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -71.18 -14.53 62.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.462 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.21 -40.4 5.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.76 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.558 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -66.17 -48.36 70.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.744 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.495 ' ND2' ' OD1' ' A' ' 31' ' ' ASN . 39.8 t-20 -57.1 -48.53 78.39 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.694 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 41.1 t -62.51 -44.72 95.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.347 0.594 . . . . 0.0 111.014 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -73.96 -46.75 42.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.869 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.809 ' O ' HG23 ' B' ' 38' ' ' VAL . 50.5 t80 -49.15 -40.46 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.891 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.521 ' NH2' ' CG ' ' A' ' 34' ' ' TYR . 42.7 ttm180 -72.57 -30.22 64.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.088 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 12.5 t -61.56 -43.19 99.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.537 HG12 HD23 ' B' ' 41' ' ' LEU . 87.3 t -73.19 -43.73 56.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 110.577 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.809 HG23 ' O ' ' B' ' 34' ' ' TYR . 88.6 t -54.71 -45.99 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.585 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 42.2 t -58.83 -41.62 87.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.381 . . . . 0.0 110.402 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 31.5 m -72.32 -46.03 57.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.207 0.527 . . . . 0.0 110.775 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.537 HD23 HG12 ' B' ' 37' ' ' VAL . 0.6 OUTLIER -53.33 -30.5 39.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.534 -179.451 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.9 t -90.71 -28.4 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.306 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -73.86 -22.4 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.48 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' B' ' 41' ' ' LEU . 44.9 p30 -79.99 -176.06 5.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.302 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -43.26 141.58 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.688 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -122.9 61.63 1.01 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.24 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.441 HG22 ' H ' ' B' ' 47' ' ' THR . 0.9 OUTLIER -63.45 -31.54 72.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.936 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -168.08 126.84 1.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.848 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.491 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 23.4 p30 -46.87 -28.46 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.491 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -73.59 -51.25 17.52 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.289 0.566 . . . . 0.0 110.555 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.9 t -49.22 -44.94 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.657 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.0 m -73.4 -35.71 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-O 121.193 0.521 . . . . 0.0 110.742 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.53 -27.97 68.18 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.537 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mttp -53.84 -44.44 70.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.987 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.48 ' HD2' HD11 ' B' ' 41' ' ' LEU . 44.2 mtt180 -68.65 -38.89 80.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.483 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.426 HD12 HG22 ' B' ' 38' ' ' VAL . 32.0 mm -63.33 -52.61 56.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.298 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -57.35 -37.69 72.98 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -74.82 -44.29 50.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.514 179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 31.9 tp -55.35 -29.67 58.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.239 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.406 ' OD1' ' OH ' ' B' ' 34' ' ' TYR . 87.9 m-20 -51.58 -38.76 55.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.333 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.75 -30.34 32.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.463 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.44 -54.02 14.05 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.487 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -50.05 -39.07 40.81 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.268 0.556 . . . . 0.0 110.074 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.483 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 50.2 t30 -72.66 -38.83 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' LYS . . . . . 0.418 ' CE ' HH21 ' B' ' 68' ' ' ARG . 46.5 mmtt -61.66 -39.57 91.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.343 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.1 t -60.3 -50.16 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.15 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 17.8 mtmt -72.72 -49.88 28.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.54 0.686 . . . . 0.0 111.661 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.418 HH21 ' CE ' ' B' ' 65' ' ' LYS . 68.8 ttp85 -57.14 -32.22 66.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.86 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.65 -12.72 84.21 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -103.88 -176.9 3.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.91 0.386 . . . . 0.0 110.559 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.494 ' O ' ' N ' ' B' ' 73' ' ' LEU . 76.7 p 48.77 -153.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.699 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttm 51.14 -87.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' B' ' 71' ' ' SER . 26.2 mt -79.71 -0.37 33.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.225 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.456 ' O ' ' O ' ' B' ' 75' ' ' HIS . 95.3 mt-10 55.18 9.69 0.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.046 0.451 . . . . 0.0 110.414 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.456 ' O ' ' O ' ' B' ' 74' ' ' GLU . 83.8 t60 58.12 145.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.643 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -91.28 140.28 29.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.951 0.405 . . . . 0.0 110.429 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 48.3 p-80 -147.59 2.8 0.73 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -65.43 -43.44 90.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -61.19 -41.5 96.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.442 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.576 -179.949 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 p 53.29 99.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.51 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -97.09 117.24 30.83 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.408 0.623 . . . . 0.0 110.158 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.09 3.7 1.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.507 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -62.29 -43.27 99.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 0.0 110.384 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -71.2 132.12 44.52 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.23 -179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.51 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -61.24 -43.75 91.09 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.6 Cg_exo -49.59 -27.46 14.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 121.104 1.203 . . . . 0.0 112.267 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.26 -42.45 99.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.527 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -58.61 -44.1 89.81 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 48.3 mt -67.44 -43.71 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.243 0.544 . . . . 0.0 110.595 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -51.94 -33.38 37.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.499 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -67.37 -32.06 72.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.077 0.465 . . . . 0.0 110.4 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.8 mt -71.41 -38.72 71.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.626 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -53.77 -34.37 58.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.046 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -66.8 -36.65 82.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.491 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -61.6 -51.91 66.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.652 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.42 -43.57 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.866 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -65.79 -51.87 55.43 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.472 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 34.9 mtt -104.5 -160.68 0.78 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.151 0.501 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -154.54 51.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.276 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -59.3 -50.56 73.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.962 0.41 . . . . 0.0 110.38 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 p -177.15 71.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.45 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -167.87 -132.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.307 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -155.44 -166.42 2.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.038 0.447 . . . . 0.0 110.406 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.92 -104.27 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.609 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.8 tt -63.41 -39.28 84.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 52.0 t-80 -63.39 10.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.159 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.542 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -76.93 -44.43 31.58 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.003 0.43 . . . . 0.0 110.638 178.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -62.86 -46.64 86.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.012 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' OD1' ' NH2' ' B' ' 35' ' ' ARG . 44.5 t30 -53.58 -48.97 68.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.641 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.4 p -64.77 -54.06 37.24 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.906 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -61.03 -42.72 99.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.316 0.579 . . . . 0.0 110.384 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.416 ' CB ' ' O ' ' A' ' 30' ' ' MET . 44.3 t80 -55.45 -48.06 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -75.56 -20.43 58.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.3 . . . . 0.0 110.471 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.9 t -68.22 -50.8 51.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.489 HG23 ' N ' ' A' ' 38' ' ' VAL . 4.7 m -74.82 -45.94 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.489 ' N ' HG23 ' A' ' 37' ' ' VAL . 55.2 t -56.45 -48.27 80.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.824 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -61.23 -42.26 98.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.4 m -69.31 -46.81 66.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.801 0.334 . . . . 0.0 110.743 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.627 HD22 HH11 ' A' ' 55' ' ' ARG . 82.5 mt -62.66 -30.37 71.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.37 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 38' ' ' VAL . 74.7 t -85.32 -38.01 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.599 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.49 -6.44 19.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.252 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.473 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 54.5 p30 -149.05 165.86 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.901 0.381 . . . . 0.0 110.506 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.484 HE22 ' NH2' ' A' ' 55' ' ' ARG . 51.0 tt0 82.78 -73.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.499 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt 43.52 42.28 3.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.119 0.485 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.8 m -62.27 -37.8 86.85 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.433 0.635 . . . . 0.0 110.227 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 57.9 tttp -178.6 145.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.516 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -57.43 -40.65 78.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.662 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.52 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -66.36 -47.74 72.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.021 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.0 t -53.58 -65.21 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.229 -178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.7 -32.14 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.955 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -41.15 96.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.883 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 25.1 mtpp -59.67 -41.98 91.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.098 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.627 HH11 HD22 ' A' ' 41' ' ' LEU . 94.0 mtt180 -65.18 -41.83 94.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.056 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.7 -51.55 49.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.429 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.438 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 15.4 mm100 -56.95 -41.19 77.85 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 19.2 m-70 -71.06 -41.88 70.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.689 0.28 . . . . 0.0 110.364 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.47 -22.56 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.598 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 4.3 p-10 -57.41 -30.49 64.98 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.486 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.5 pt-20 -60.7 -33.64 73.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 0.0 110.257 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.11 -57.46 4.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.883 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.98 -39.21 25.71 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.45 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 52.4 t30 -70.87 -39.95 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.931 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -60.66 -46.82 88.86 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 84.3 t -54.83 -55.07 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.163 -0.615 . . . . 0.0 110.326 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HD2' HD11 ' A' ' 27' ' ' ILE . 16.1 mtmt -60.35 -46.22 90.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.177 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.0 tpt85 -58.25 -14.06 6.41 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.719 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.88 9.1 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 -54.41 -104.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.2 p -166.8 -128.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 pttm -160.04 83.65 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.34 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.2 tp -172.64 51.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.244 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -89.86 63.95 6.22 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.945 0.402 . . . . 0.0 110.208 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 58.85 77.78 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.446 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.5 m80 54.36 87.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.322 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' A' ' 79' ' ' HIS . 10.1 t-80 -75.55 107.53 7.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.964 0.412 . . . . 0.0 110.339 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -54.29 -76.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.569 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.476 ' O ' ' ND1' ' A' ' 77' ' ' HIS . 72.1 m80 -61.15 159.96 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.442 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 74.1 m80 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.464 -179.886 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mmt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -157.05 -6.27 0.1 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.562 ' C ' ' H ' ' B' ' 5' ' ' PHE . 94.7 mt-10 -71.46 -120.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.121 0.486 . . . . 0.0 110.382 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 40.3 mt 61.79 -6.27 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.767 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.562 ' H ' ' C ' ' B' ' 3' ' ' GLU . 43.1 m-85 -71.15 -33.9 70.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.257 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -74.12 133.11 42.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.1 t -72.43 -38.48 5.34 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-O 119.306 -0.378 . . . . 0.0 109.992 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 59.6 Cg_exo -53.48 -28.61 45.5 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.379 1.386 . . . . 0.0 111.806 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -60.64 -44.46 96.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.68 0.276 . . . . 0.0 110.352 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.46 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.1 m-85 -58.18 -37.53 74.93 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.147 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.68 -47.1 72.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.37 -25.91 6.87 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.525 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -70.31 -31.42 68.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.373 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.69 -39.74 66.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.685 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -32.83 68.09 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.041 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -66.37 -30.65 71.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.573 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -69.16 -51.98 32.74 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.712 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 pt -72.81 -44.44 58.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 121.044 0.45 . . . . 0.0 110.709 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.71 -53.02 57.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.693 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.9 mmt -96.29 -147.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 109.874 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -171.21 45.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.013 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.1 mt-30 -54.85 -46.12 74.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.659 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t 178.52 68.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.445 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLU . . . . . 0.415 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 16.9 tp10 -160.9 -130.99 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.399 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -160.37 -171.81 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.362 0.601 . . . . 0.0 110.369 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -78.44 -106.45 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.132 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.488 ' C ' ' H ' ' B' ' 29' ' ' ALA . 20.0 tt -64.83 -32.79 59.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.615 0.245 . . . . 0.0 110.691 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.09 7.78 0.26 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.608 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.07 -43.0 36.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.267 0.556 . . . . 0.0 110.575 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.476 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 16.2 ptt? -59.45 -47.1 86.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.355 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.476 ' N ' ' CG ' ' B' ' 30' ' ' MET . 33.6 m120 -54.14 -43.41 70.51 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.501 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.415 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 78.3 p -70.65 -55.43 8.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.727 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.46 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 42.2 t80 -59.59 -46.15 89.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.216 0.531 . . . . 0.0 110.598 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.418 ' CB ' ' O ' ' B' ' 30' ' ' MET . 59.4 t80 -55.77 -48.55 75.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.004 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.476 ' NH2' ' OD1' ' A' ' 31' ' ' ASN . 44.5 ttm180 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.393 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.5 t -70.04 -50.99 35.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.896 0.379 . . . . 0.0 110.488 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.0 t -68.18 -56.73 11.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.5 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 69.1 t -48.44 -49.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.328 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 71.3 m -57.81 -36.41 72.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.3 m -71.21 -49.99 37.73 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.949 0.404 . . . . 0.0 111.309 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.3 mt -53.23 -36.62 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.294 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.1 -38.63 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.411 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -115.93 78.16 1.16 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.407 0.622 . . . . 0.0 110.237 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -178.38 -69.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.765 0.793 . . . . 0.0 110.716 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 67.8 tp60 -86.34 -74.89 0.4 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.54 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tt 69.28 43.67 1.04 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.165 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -80.75 -27.69 36.73 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.334 0.587 . . . . 0.0 110.524 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -178.7 145.81 0.32 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 50' ' ' ALA . 18.3 p-10 -64.26 -45.03 89.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.56 -39.93 85.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.832 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 12.6 t -57.93 -62.11 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.845 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -54.19 -33.81 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.574 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.72 -60.63 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.689 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -58.23 -35.59 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.929 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -62.91 -35.72 81.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.078 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 88.4 mt -71.23 -46.2 66.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.492 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -54.75 -25.37 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.14 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -70.2 -44.97 67.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.211 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.408 HD13 ' HB3' ' B' ' 62' ' ' ALA . 0.5 OUTLIER -51.61 -20.98 2.25 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.591 -179.383 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -59.46 -45.31 91.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.178 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.14 -37.68 88.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.065 0.46 . . . . 0.0 110.654 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' ALA . . . . . 0.408 ' HB3' HD13 ' B' ' 59' ' ' LEU . . . -72.36 -53.89 11.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.913 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.03 -37.71 21.57 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.101 0.476 . . . . 0.0 109.773 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -65.6 -37.21 85.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.652 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 15.5 tptp -55.34 -39.57 70.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.717 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.24 -39.27 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-O 121.836 0.827 . . . . 0.0 110.515 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -64.91 -46.85 79.95 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.803 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -86.05 -12.24 50.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.336 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -92.57 -37.15 5.91 Favored Glycine 0 N--CA 1.476 1.364 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' B' ' 71' ' ' SER . 1.1 pp20? -67.34 -165.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.012 0.434 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.408 ' O ' ' OE2' ' B' ' 70' ' ' GLU . 31.3 t -44.5 109.21 0.14 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.194 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.8 tttt 179.61 12.08 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.38 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 75' ' ' HIS . 41.0 tp -173.82 -99.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 37.34 22.83 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.325 0.583 . . . . 0.0 111.182 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.612 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 0.0 OUTLIER -46.07 -87.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.429 -178.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.612 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 79.4 m80 -97.83 159.2 15.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -163.37 137.33 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.296 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -71.5 149.0 46.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.286 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -58.99 -42.57 90.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.454 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.1 p80 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.607 179.915 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.4 mtp . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 p -77.47 178.96 6.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.41 ' C ' ' N ' ' A' ' 5' ' ' PHE . 96.2 mt-10 -70.41 147.4 49.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.386 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.3 mt 53.65 11.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.41 ' N ' ' C ' ' A' ' 3' ' ' GLU . 73.1 t80 -61.24 -47.39 86.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.384 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -91.56 127.48 37.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.407 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.464 ' CG1' ' NE2' ' A' ' 58' ' ' HIS . 1.0 OUTLIER -58.52 -46.52 99.6 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.748 179.001 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 99.1 Cg_exo -40.66 -29.78 0.46 Allowed 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 121.248 1.299 . . . . 0.0 112.764 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -59.15 -48.36 81.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.183 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -47.15 85.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.763 0.316 . . . . 0.0 110.26 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.9 mt -61.14 -47.44 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 121.324 0.583 . . . . 0.0 110.41 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -46.27 -32.55 3.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.745 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -60.85 -35.75 77.36 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.2 mp -76.52 -40.06 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.782 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -62.59 -35.43 79.5 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.867 0.365 . . . . 0.0 110.256 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.48 -29.94 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.584 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -72.68 -56.04 5.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.462 HG22 ' HA ' ' A' ' 26' ' ' LYS . 2.1 pt -67.38 -42.33 87.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.335 0.588 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.8 tt0 -62.24 -53.42 55.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.639 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.3 mtt -98.58 -132.4 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -170.35 50.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.449 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -58.1 -50.58 72.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.596 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.0 p -174.19 21.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -134.9 175.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.368 1.08 . . . . 0.0 109.806 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -112.23 -126.5 0.28 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.364 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HA ' HG22 ' A' ' 18' ' ' ILE . 99.4 mttt -113.42 -87.93 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.663 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.4 mm -68.12 -24.17 29.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.683 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -84.67 -9.7 58.0 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.376 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 -51.23 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.828 0.347 . . . . 0.0 110.496 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.556 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -64.14 -41.06 97.35 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.556 ' N ' ' SD ' ' A' ' 30' ' ' MET . 50.3 t30 -56.62 -51.78 67.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.354 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.9 t -65.27 -51.36 61.3 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.773 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -60.71 -53.55 56.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.46 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.428 ' N ' ' O ' ' A' ' 30' ' ' MET . 38.3 t80 -54.84 -48.75 72.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.903 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.3 tpt180 -60.28 -40.03 88.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.918 0.389 . . . . 0.0 110.183 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.1 m -64.8 -41.14 96.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.0 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.23 -60.44 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.63 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 39' ' ' SER . 8.3 p -52.15 -43.42 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.252 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.502 ' N ' HG13 ' A' ' 38' ' ' VAL . 69.6 m -62.53 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -57.94 -43.99 86.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.375 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.21 -45.63 62.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.259 0.552 . . . . 0.0 110.631 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.691 HG12 ' O ' ' A' ' 42' ' ' VAL . 61.0 t -82.33 26.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.29 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -159.98 19.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.319 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -168.77 21.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.231 . . . . 0.0 110.467 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -172.3 62.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.488 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 30.8 mt -100.66 50.52 0.88 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.369 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.2 t -72.31 -34.68 68.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.385 0.612 . . . . 0.0 110.436 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -163.92 132.07 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.439 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 19.4 p30 -48.59 -36.63 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.605 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.439 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -69.18 -53.24 21.05 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 111.03 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.6 t -48.24 -44.31 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.564 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -75.8 -40.16 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.985 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 14.2 mt -59.34 -40.5 86.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.548 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -52.82 -50.2 64.14 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.531 -0.467 . . . . 0.0 109.921 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -62.38 -43.16 99.49 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.259 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.5 mt -64.01 -55.64 20.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.638 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -50.92 -41.26 58.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.167 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.464 ' NE2' ' CG1' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -73.05 -43.45 61.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.902 179.468 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 41.3 tp -56.89 -29.63 63.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.782 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -52.79 -52.56 56.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.246 -0.582 . . . . 0.0 110.377 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -51.39 -29.49 15.81 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.758 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -66.34 -62.26 1.57 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.764 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -43.36 64.69 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -61.61 -25.77 67.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.25 -179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.559 ' NZ ' ' NH2' ' A' ' 68' ' ' ARG . 31.2 tptt -75.1 -32.74 61.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.622 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.5 t -67.21 -52.4 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-O 121.367 0.604 . . . . 0.0 110.465 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -47.17 79.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.84 0.828 . . . . 0.0 111.6 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.559 ' NH2' ' NZ ' ' A' ' 65' ' ' LYS . 70.7 ttp85 -57.17 -24.74 56.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.981 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -84.22 -16.21 67.5 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -92.66 175.82 6.67 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.167 0.508 . . . . 0.0 110.492 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.5 m 46.53 -172.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.398 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -141.86 -65.95 0.41 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.534 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' O ' ' CD2' ' A' ' 75' ' ' HIS . 4.3 mm? -53.3 -57.68 9.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 58.55 48.5 11.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.315 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.494 ' CD2' ' O ' ' A' ' 73' ' ' LEU . 89.6 m-70 -148.3 163.12 38.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.488 0.661 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 76' ' ' HIS . 18.8 t-80 -132.59 45.86 2.7 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.699 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.0 m-70 -79.18 54.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.385 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -61.35 -45.9 92.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.446 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -134.77 -47.23 0.74 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.728 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.9 t60 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.508 -179.82 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 79.2 p -156.42 129.0 7.68 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.589 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -93.98 78.58 4.11 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.373 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 54.4 mt -69.91 -21.79 63.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.321 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -59.48 -42.46 92.13 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.271 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -86.15 126.71 34.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.507 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.4 t -60.58 -41.98 85.86 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.662 -0.685 . . . . 0.0 109.837 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.507 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 79.9 Cg_exo -47.21 -34.27 17.61 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 121.123 1.215 . . . . 0.0 112.223 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -55.45 -41.95 73.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.183 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -44.83 95.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.383 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.414 ' O ' ' N ' ' B' ' 14' ' ' LEU . 30.5 mt -60.61 -48.29 89.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.456 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -45.31 -32.4 1.99 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.66 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -59.14 -35.31 73.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.639 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.0 mp -73.19 -38.22 66.22 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.775 0.321 . . . . 0.0 110.307 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.95 -34.41 77.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.043 0.449 . . . . 0.0 110.315 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -64.51 -28.85 69.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.626 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -72.18 -53.63 12.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.858 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.447 HD12 ' OE1' ' B' ' 70' ' ' GLU . 6.2 pt -70.63 -43.04 77.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.313 0.577 . . . . 0.0 110.729 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.09 -39.55 82.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.204 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -126.0 -135.26 0.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.907 0.385 . . . . 0.0 110.552 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -173.3 55.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.268 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -60.07 -44.82 94.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.285 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t 175.33 71.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -166.25 -124.76 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.798 0.332 . . . . 0.0 110.393 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -156.94 -168.71 2.73 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.312 0.577 . . . . 0.0 110.006 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -89.8 -98.63 0.1 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.37 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.1 mm -61.5 -44.42 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.811 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -57.58 -8.35 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.582 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.66 -48.34 75.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.532 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.427 ' O ' ' N ' ' B' ' 34' ' ' TYR . 2.3 ptm -67.15 -50.31 61.71 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.457 ' OD1' ' NH1' ' A' ' 35' ' ' ARG . 91.5 m-20 -56.89 -44.76 82.62 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.508 -179.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -69.96 -51.23 34.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.805 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.523 ' CE1' HD11 ' B' ' 14' ' ' LEU . 44.5 t80 -63.63 -51.65 64.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.827 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.769 ' O ' HG23 ' B' ' 38' ' ' VAL . 57.0 t80 -52.66 -44.44 66.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.022 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -69.33 -36.7 77.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.573 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 45.1 m -60.55 -39.12 86.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.407 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.74 -54.97 13.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.32 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.769 HG23 ' O ' ' B' ' 34' ' ' TYR . 49.1 t -48.49 -38.21 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.501 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.403 ' O ' ' CB ' ' B' ' 43' ' ' GLN . 77.6 p -64.95 -47.11 78.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.087 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -65.57 -46.12 80.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.445 0.641 . . . . 0.0 111.234 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -62.9 -34.99 78.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.651 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 79.2 t -85.59 -37.99 12.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 39' ' ' SER . 47.8 tt0 -75.93 -0.5 21.66 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.661 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' B' ' 41' ' ' LEU . 46.6 m-20 -157.13 171.54 20.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 52.24 42.36 30.77 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.578 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.98 43.63 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.422 HG23 ' N ' ' B' ' 48' ' ' LYS . 4.6 t -65.4 -43.21 91.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.446 0.641 . . . . 0.0 110.557 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' B' ' 50' ' ' ALA . 28.7 tptp -158.22 131.47 7.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.643 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -46.54 -42.78 16.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.267 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.437 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -62.28 -50.84 70.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.934 179.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 28.5 t -51.0 -46.85 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.451 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.424 ' O ' HG12 ' B' ' 56' ' ' ILE . 29.3 m -76.3 -45.09 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 121.594 0.711 . . . . 0.0 111.146 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.417 ' N ' HG23 ' B' ' 52' ' ' VAL . 60.9 tp -56.84 -42.69 80.11 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.606 -178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -53.48 -45.33 69.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.184 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -40.13 90.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.424 HG12 ' O ' ' B' ' 52' ' ' VAL . 26.2 mm -65.43 -52.3 53.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.445 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -52.7 -47.25 67.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.185 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -67.09 -44.88 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.283 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.6 tp -52.17 -27.49 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.319 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -52.16 -45.11 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.348 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -50.07 -28.45 7.16 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.708 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.87 -63.49 1.05 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.705 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -47.47 -46.35 26.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.38 0.609 . . . . 0.0 110.083 -179.74 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.469 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.2 t-20 -59.22 -36.75 75.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.055 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.1 tptp -60.81 -34.29 74.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.439 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 60.0 t -69.92 -51.24 41.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.523 0.678 . . . . 0.0 110.497 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' B' ' 69' ' ' GLY . 5.4 mmmt -72.92 -21.75 60.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.564 1.173 . . . . 0.0 112.359 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -38.54 -27.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.685 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' B' ' 67' ' ' LYS . . . 155.27 66.67 0.01 OUTLIER Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' B' ' 18' ' ' ILE . 60.3 mm-40 -112.4 -26.68 8.6 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 64.2 m -81.05 -8.12 59.7 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.021 0.439 . . . . 0.0 110.763 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' B' ' 74' ' ' GLU . 64.4 mttp -81.06 96.96 7.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.301 0.572 . . . . 0.0 110.079 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.445 ' O ' ' O ' ' B' ' 74' ' ' GLU . 0.5 OUTLIER -68.62 72.44 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.272 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' B' ' 73' ' ' LEU . 90.6 mt-10 -52.0 -105.26 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.648 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 55.4 t-80 -139.59 111.16 7.15 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.401 ' ND1' ' N ' ' B' ' 76' ' ' HIS . 1.7 m80 52.6 176.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.61 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -63.62 -41.05 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.35 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.469 ' O ' ' CG ' ' B' ' 79' ' ' HIS . 85.6 t60 -145.73 -83.58 0.13 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.554 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' B' ' 78' ' ' HIS . 77.9 m80 -157.52 -40.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.601 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' HIS . . . . . 0.453 ' ND1' ' N ' ' B' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.626 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mmm . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.4 t -60.58 -43.28 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -51.68 147.34 6.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.588 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tt 74.65 -59.24 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.643 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -59.56 -41.16 89.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.49 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -69.46 142.06 53.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.351 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.547 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 4.3 t -67.13 -42.4 40.43 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.107 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 68.2 Cg_exo -49.23 -24.37 8.12 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 121.529 1.486 . . . . 0.0 112.125 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -70.14 -41.29 74.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.183 0.516 . . . . 0.0 110.449 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.414 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -62.81 -47.29 84.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.274 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.11 -42.97 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.342 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -49.27 -25.15 2.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.717 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -75.63 -38.03 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.077 0.465 . . . . 0.0 110.599 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 43.6 mt -63.71 -39.33 94.03 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.548 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -55.32 -36.74 66.54 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.236 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.6 tt0 -65.77 -32.42 73.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.517 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.69 -52.28 46.49 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.806 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 8.3 pt -73.96 -45.94 47.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.848 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 11.6 tm-20 -66.84 -50.37 62.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.426 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 4.1 tpp -94.79 -165.11 1.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.696 0.76 . . . . 0.0 109.934 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -154.56 44.11 0.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.257 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -56.98 -53.36 58.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.177 0.513 . . . . 0.0 110.286 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -174.73 70.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.385 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.71 -135.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.964 0.411 . . . . 0.0 110.204 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -156.57 -165.93 2.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.46 0.648 . . . . 0.0 109.928 -179.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.489 ' HZ3' HG12 ' A' ' 27' ' ' ILE . 17.9 ttpp -85.0 -103.23 0.05 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.451 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.532 ' C ' ' H ' ' A' ' 29' ' ' ALA . 3.3 mm -63.02 -38.99 83.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -64.54 8.34 0.12 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.804 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.46 -48.47 22.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.458 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.527 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.45 -43.94 96.33 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.277 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' ' SD ' ' A' ' 30' ' ' MET . 74.8 m-20 -52.42 -46.18 66.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.323 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -70.74 -54.88 10.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.806 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.414 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 44.5 t80 -58.88 -49.26 78.43 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.243 0.544 . . . . 0.0 110.669 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.794 ' O ' HG23 ' A' ' 38' ' ' VAL . 72.0 t80 -58.07 -48.47 80.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.904 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -66.74 -36.27 82.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.958 0.409 . . . . 0.0 110.41 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -62.77 -44.2 96.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.634 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -71.55 -51.83 30.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.374 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 34' ' ' TYR . 88.3 t -51.19 -48.81 31.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.246 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -60.45 -39.61 88.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.2 m -65.7 -48.19 72.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.271 0.557 . . . . 0.0 110.863 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 44' ' ' ASP . 99.1 mt -56.91 -33.36 66.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.758 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -87.34 -38.47 12.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.309 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -53.17 -12.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.664 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.447 ' O ' ' O ' ' A' ' 41' ' ' LEU . 3.4 m-20 -173.01 -172.88 0.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.178 0.513 . . . . 0.0 110.003 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 58.04 33.22 22.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.96 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.63 44.33 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.452 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -64.31 -29.65 70.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.587 . . . . 0.0 110.702 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 87.8 tttt -168.22 131.3 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.713 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -48.42 -38.22 19.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.524 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.491 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -67.05 -49.06 66.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.803 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -51.83 -45.11 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.374 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.481 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.4 m -77.79 -43.72 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.835 0.826 . . . . 0.0 111.116 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.433 ' N ' HG23 ' A' ' 52' ' ' VAL . 5.4 tt -63.69 -41.73 98.1 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.264 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -53.11 -40.01 63.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.987 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.435 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 53.1 mtp180 -67.51 -35.45 79.14 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 52' ' ' VAL . 40.9 mm -65.05 -51.11 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.58 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.448 ' OE1' HG11 ' B' ' 42' ' ' VAL . 27.7 mm100 -57.65 -39.35 76.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.435 ' ND1' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -72.81 -46.37 53.49 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.089 0.471 . . . . 0.0 110.167 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' N ' ' CG ' ' A' ' 58' ' ' HIS . 29.5 tp -55.71 -25.02 38.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.631 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.39 -34.92 73.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.987 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.28 -32.24 72.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.955 0.407 . . . . 0.0 110.477 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.98 -54.27 13.99 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.81 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -46.71 69.21 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.966 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -62.49 -34.5 76.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.266 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -63.12 -37.85 88.87 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.404 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.8 t -57.86 -53.64 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.197 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -64.69 -44.27 90.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.746 0.784 . . . . 0.0 111.4 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -53.87 -27.86 32.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.019 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -86.09 -15.05 65.6 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -95.52 174.41 7.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.106 0.479 . . . . 0.0 110.229 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.8 p -157.71 163.77 37.82 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.176 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -159.52 -19.4 0.07 Allowed 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.249 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -169.69 159.53 8.24 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.375 0.607 . . . . 0.0 110.353 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -128.69 -29.72 2.35 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.43 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -64.96 -170.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.783 0.325 . . . . 0.0 110.494 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -147.79 142.14 26.29 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.143 0.497 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -74.2 -16.96 60.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.452 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.1 t60 53.61 98.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.551 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -65.23 130.57 43.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.469 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 61.8 t-80 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.798 -179.966 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 52.9 m -156.28 165.46 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.548 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 56.3 59.13 3.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.379 0.609 . . . . 0.0 110.843 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.56 ' O ' ' N ' ' B' ' 6' ' ' SER . 4.0 mm? -66.24 -38.98 89.16 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.912 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.553 ' O ' ' CB ' ' B' ' 6' ' ' SER . 98.7 m-85 -46.59 88.7 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 122.256 1.027 . . . . 0.0 110.088 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.56 ' N ' ' O ' ' B' ' 4' ' ' LEU . 8.4 p 144.59 69.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.448 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.491 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.8 t -35.77 -54.66 1.31 Allowed Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.701 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 12.6 Cg_endo -51.42 -21.59 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 121.305 1.337 . . . . 0.0 112.331 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 6' ' ' SER . 16.8 t80 -64.98 -47.54 77.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.338 0.589 . . . . 0.0 110.713 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.9 OUTLIER -72.95 -47.54 44.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.359 -179.472 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.5 mt -58.79 -42.15 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.159 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -47.42 -26.03 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.665 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -74.08 -43.64 56.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.508 . . . . 0.0 110.464 179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.96 -36.42 77.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.896 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LYS . . . . . 0.45 ' NZ ' ' OE1' ' B' ' 19' ' ' GLU . 26.3 ttpp -58.78 -46.81 86.67 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.01 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -65.56 -29.05 69.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.578 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -68.19 -52.7 31.47 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.686 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.403 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.4 pt -74.78 -46.2 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.014 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' GLU . . . . . 0.45 ' OE1' ' NZ ' ' B' ' 15' ' ' LYS . 82.7 tt0 -56.0 -54.66 42.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.553 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 45.7 mtt -97.87 -137.53 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.866 0.365 . . . . 0.0 110.039 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -171.38 43.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.305 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -55.99 -47.84 76.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.3 p -173.9 68.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.318 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -166.9 -137.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.927 0.394 . . . . 0.0 110.422 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -156.27 -156.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.397 0.618 . . . . 0.0 109.891 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.403 ' O ' HG22 ' B' ' 18' ' ' ILE . 1.7 ttmp? -93.81 -103.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.978 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.462 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.1 mm -62.18 -39.36 83.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -67.77 7.56 0.49 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.653 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.462 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.75 -48.39 22.0 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.05 0.453 . . . . 0.0 110.651 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.631 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -64.68 -46.05 84.03 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.298 179.51 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.555 ' N ' ' SD ' ' B' ' 30' ' ' MET . 26.0 t-20 -51.18 -52.86 40.22 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.064 -0.655 . . . . 0.0 110.912 -178.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 10.8 t -60.64 -46.84 88.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.791 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 47.1 t80 -72.79 -20.03 61.24 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.623 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.631 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.0 t80 -73.79 -55.43 6.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.289 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.37 -26.59 68.08 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.415 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 82.8 p -66.57 -46.56 75.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.35 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 55.8 t -70.18 -49.63 53.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.149 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.49 -49.28 84.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.361 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -65.5 -17.86 64.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 110.633 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -87.32 -52.02 5.62 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.84 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 43' ' ' GLN . 97.8 mt -66.99 -40.92 87.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.609 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.662 ' O ' HG12 ' B' ' 42' ' ' VAL . 61.7 t -77.89 18.4 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.048 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 41' ' ' LEU . 30.8 mt-30 -145.13 -1.45 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.727 0.299 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -114.2 -30.61 6.58 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.491 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -152.24 86.83 1.3 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.936 0.398 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.13 40.08 1.74 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.506 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -62.81 -17.94 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 110.401 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.682 ' O ' HG22 ' B' ' 51' ' ' VAL . 16.9 tptm -168.19 122.72 0.94 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.184 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -54.43 -15.98 2.01 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.049 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.436 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -80.31 -59.62 2.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.012 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.682 HG22 ' O ' ' B' ' 48' ' ' LYS . 23.1 m -45.93 -36.74 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.58 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.429 ' N ' HG23 ' B' ' 51' ' ' VAL . 32.7 m -77.53 -31.95 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.724 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' B' ' 50' ' ' ALA . 50.1 tp -58.05 -37.91 75.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.948 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.466 ' C ' ' HE ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -58.89 -45.48 90.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.386 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.564 ' HE ' ' N ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -64.3 -44.23 92.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.777 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.38 -51.54 69.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.581 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -56.52 -44.45 80.8 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 47.1 m170 -68.3 -42.09 79.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 tp -52.15 -26.03 10.39 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.741 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.39 -30.13 66.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -61.43 -36.75 81.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.889 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.43 -58.88 3.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -44.22 61.45 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.026 0.441 . . . . 0.0 110.014 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.62 -40.92 98.49 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.306 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 57.2 tttm -66.96 -35.32 79.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.173 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.66 -49.99 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.446 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.27 69.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.798 0.809 . . . . 0.0 111.582 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -63.84 -37.52 87.68 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.027 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.55 -26.9 72.2 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -86.22 -46.72 10.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.612 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 13.9 m -61.43 164.09 6.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.466 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 53.91 -137.57 1.2 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.391 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.501 HD12 ' N ' ' B' ' 73' ' ' LEU . 10.1 mp 41.33 -105.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.573 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' B' ' 73' ' ' LEU . 80.7 mm-40 33.34 -93.05 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.827 0.823 . . . . 0.0 110.524 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.63 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 43.2 t-80 58.46 -176.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.199 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.63 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 96.5 m-70 -135.42 42.46 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.29 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -79.38 77.66 5.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.956 0.407 . . . . 0.0 110.023 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' B' ' 80' ' ' HIS . 73.9 m80 52.62 71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 86.2 t60 53.9 -86.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.566 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' HIS . . . . . 0.474 ' N ' ' O ' ' B' ' 78' ' ' HIS . 45.9 p-80 . . . . . 0 C--O 1.221 -0.437 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.68 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.8 p -160.48 164.11 32.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.177 0.513 . . . . 0.0 110.477 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -135.51 76.85 1.64 Allowed 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.622 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pp -171.44 3.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -61.01 -42.06 97.73 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.363 0.601 . . . . 0.0 110.317 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t -52.52 127.67 23.41 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.466 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.58 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.5 t -51.69 -54.2 42.41 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 7.9 Cg_endo -46.99 -16.65 0.32 Allowed 'Trans proline' 0 C--N 1.306 -1.698 0 C-N-CA 122.045 1.83 . . . . 0.0 112.099 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -70.65 -47.13 61.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.114 0.483 . . . . 0.0 110.691 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.431 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.0 m-85 -62.97 -42.51 99.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.465 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 93.9 mt -65.43 -43.62 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.467 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -51.37 -26.27 7.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.436 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -72.95 -36.63 67.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.123 0.487 . . . . 0.0 110.597 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.41 -38.88 85.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.452 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.34 -37.0 74.27 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.105 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' MET . 59.2 tt0 -65.71 -30.27 70.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.651 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -68.63 -52.75 27.98 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.68 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.54 -44.59 53.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 0.0 110.965 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -67.79 -39.45 84.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.216 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.412 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 6.0 ttm -111.66 -163.21 0.84 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.529 0.68 . . . . 0.0 110.247 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -156.79 46.29 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.267 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -58.2 -49.46 76.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.176 0.512 . . . . 0.0 110.387 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -176.21 69.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -165.45 -133.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.272 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -157.0 -165.38 1.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.246 0.546 . . . . 0.0 110.124 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -81.37 -108.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.258 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.558 HD13 ' OE2' ' A' ' 70' ' ' GLU . 5.8 tp -63.87 -35.71 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.44 ' HA ' HD21 ' A' ' 31' ' ' ASN . 75.3 m80 -63.53 5.83 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.577 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.1 -43.15 54.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.5 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -62.6 -44.27 96.73 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.737 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' A' ' 30' ' ' MET . 76.4 m-20 -52.49 -54.8 27.63 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.648 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.0 m -62.05 -55.25 31.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.431 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 55.1 t80 -57.23 -41.0 78.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.187 0.518 . . . . 0.0 110.596 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.43 ' O ' HG22 ' A' ' 38' ' ' VAL . 26.2 t80 -63.67 -52.37 60.99 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.989 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.526 HH12 ' CE ' ' B' ' 30' ' ' MET . 82.4 mtp180 -65.86 -27.14 68.01 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.2 p -72.0 -44.25 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.74 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.1 t -66.87 -63.11 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.763 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 39' ' ' SER . 22.8 m -49.13 -45.84 17.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.338 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.563 ' N ' HG23 ' A' ' 38' ' ' VAL . 64.7 p -58.42 -43.62 88.76 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.202 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.485 ' O ' ' N ' ' A' ' 44' ' ' ASP . 97.0 m -65.49 -46.84 78.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 110.65 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.534 HD22 HH11 ' A' ' 55' ' ' ARG . 88.5 mt -63.65 -43.49 96.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.579 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 42' ' ' VAL . 32.1 t -85.7 29.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.357 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.408 ' H ' ' H ' ' A' ' 44' ' ' ASP . 61.1 tp60 -160.68 -14.27 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.7 0.286 . . . . 0.0 110.796 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' THR . 31.4 t70 -114.37 -34.4 5.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.415 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -96.08 -79.59 0.44 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.543 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.4 mt 52.49 43.27 31.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.977 0.418 . . . . 0.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -88.65 -26.42 21.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.519 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -172.51 134.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.904 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 91.6 m-20 -54.72 -41.32 70.19 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.47 87.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.016 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.08 -43.59 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.523 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 56' ' ' ILE . 34.1 m -76.5 -36.85 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.406 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -59.94 -54.74 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.857 -177.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -38.71 92.01 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.428 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.534 HH11 HD22 ' A' ' 41' ' ' LEU . 42.3 ttm180 -65.49 -42.1 92.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.496 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 52' ' ' VAL . 71.3 mt -65.47 -45.79 91.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.497 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -54.63 -36.5 64.59 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.439 ' ND1' ' OE2' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -66.47 -35.53 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.619 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -62.35 -40.24 95.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.522 -177.329 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -50.21 -29.88 10.36 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE2' ' ND1' ' A' ' 58' ' ' HIS . 4.9 pt-20 -60.34 -34.4 73.79 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.418 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.74 -49.26 26.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.954 0.407 . . . . 0.0 110.738 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.86 -38.44 64.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.909 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -69.32 -36.86 77.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.62 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -60.19 -39.27 85.92 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.227 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.83 -47.32 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 122.041 0.924 . . . . 0.0 110.414 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -61.46 -41.42 97.2 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.47 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 55.9 ttt85 -67.53 -14.21 62.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.108 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.59 -63.01 1.12 Allowed Glycine 0 N--CA 1.461 0.363 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.595 ' CG ' ' H ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -50.17 -99.71 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.506 0.193 . . . . 0.0 110.742 -179.907 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.595 ' H ' ' CG ' ' A' ' 70' ' ' GLU . 41.8 t -65.32 90.79 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.398 0.618 . . . . 0.0 110.347 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -60.35 -38.86 85.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.254 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.547 ' O ' ' N ' ' A' ' 75' ' ' HIS . 8.1 tp -141.8 -52.98 0.43 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.771 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.58 67.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.682 . . . . 0.0 110.763 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 73' ' ' LEU . 52.6 t-80 -106.21 59.75 0.65 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.3 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 54.33 79.89 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.727 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -77.56 -160.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.329 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 71.9 m80 54.82 173.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.471 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -73.73 151.26 40.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.518 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.735 -179.78 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mmm . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 43.7 t -67.44 147.66 52.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.521 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -164.67 144.72 7.47 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.356 0.598 . . . . 0.0 110.444 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.59 -29.03 66.12 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.089 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -54.19 -41.31 68.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.211 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -69.12 125.82 27.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.117 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.559 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.4 OUTLIER -64.93 -42.53 63.18 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 70.9 Cg_exo -51.95 -22.25 13.88 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 121.896 1.73 . . . . 0.0 111.984 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -61.91 -42.39 99.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.437 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -64.4 -38.12 89.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.192 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.9 mt -64.23 -44.88 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -49.89 -22.54 1.54 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.573 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -69.7 -40.03 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.328 0.585 . . . . 0.0 110.553 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.04 -36.11 66.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -58.11 -32.83 68.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' B' ' 20' ' ' MET . 57.4 tt0 -75.13 -30.05 60.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.457 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -67.09 -51.44 54.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 0.0 110.661 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.431 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.5 pt -69.93 -41.82 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.497 0.665 . . . . 0.0 110.757 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -73.68 -51.72 15.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.661 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.412 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.0 tpp -90.2 -66.57 0.91 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.11 0.481 . . . . 0.0 110.583 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 t30 76.71 43.07 0.14 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.797 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -55.25 -35.95 65.53 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.332 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 90.8 p -163.45 63.57 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.651 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -161.15 -132.82 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.39 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -153.21 -170.31 3.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.342 0.591 . . . . 0.0 110.316 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.431 ' O ' HG22 ' B' ' 18' ' ' ILE . 59.7 tttp -80.96 -108.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.442 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.658 HD11 ' HD2' ' B' ' 67' ' ' LYS . 21.0 tt -62.22 -38.47 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.34 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' HIS . . . . . 0.414 ' N ' HG23 ' B' ' 27' ' ' ILE . 80.7 m80 -58.48 -12.44 3.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.541 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.12 -41.62 49.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.522 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.545 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -65.38 -51.52 59.82 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.251 179.083 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.537 ' N ' ' SD ' ' B' ' 30' ' ' MET . 42.4 t30 -53.33 -37.28 62.16 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.243 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . 79.5 p -76.73 -52.36 9.74 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.026 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.437 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 85.0 t80 -65.84 -38.16 88.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.398 0.618 . . . . 0.0 110.921 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.545 ' N ' ' O ' ' B' ' 30' ' ' MET . 58.6 t80 -62.08 -56.63 16.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.423 -179.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 32' ' ' SER . 36.9 ptt180 -60.47 -25.52 66.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.16 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.19 -45.88 53.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.726 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -67.45 -64.76 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.362 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 39' ' ' SER . 19.4 m -45.41 -41.32 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.474 -179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.502 ' N ' HG23 ' B' ' 38' ' ' VAL . 14.0 t -60.26 -42.08 94.58 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -67.27 -46.12 74.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.797 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.4 mm? -59.84 -37.0 78.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.215 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.1 t -80.77 -38.14 16.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.365 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.38 -11.69 7.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.431 ' O ' ' O ' ' B' ' 41' ' ' LEU . 79.2 m-20 -143.55 161.79 37.55 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 121.318 0.58 . . . . 0.0 110.229 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 47.9 tt0 73.47 162.19 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.997 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 178.26 25.02 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -63.02 -32.07 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.113 0.482 . . . . 0.0 110.404 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -170.67 123.73 0.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.786 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 13.5 p30 -47.26 -29.71 2.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.437 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -73.8 -47.04 41.6 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.19 0.519 . . . . 0.0 110.694 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.1 t -50.22 -42.68 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.304 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.3 m -76.14 -33.47 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.11 -40.85 98.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.43 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 36.8 pttt -53.0 -39.01 62.79 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -66.53 -40.75 89.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.132 -179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.72 -50.94 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.297 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -57.88 -39.21 77.28 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.43 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 6.1 m-70 -74.03 -38.13 64.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.109 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 tp -56.07 -30.59 62.2 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.582 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.468 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 91.9 m-20 -52.47 -28.5 20.5 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.495 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -62.1 -35.27 78.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.799 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.01 -53.29 13.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.688 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -45.82 72.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.018 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 75.6 m-20 -63.45 -36.27 83.18 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.002 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' LYS . . . . . 0.412 ' HD2' HH21 ' B' ' 68' ' ' ARG . 34.5 tptt -61.37 -37.8 84.68 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.56 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.9 t -60.5 -58.22 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.284 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.658 ' HD2' HD11 ' B' ' 27' ' ' ILE . 16.4 mtmt -62.13 -47.04 86.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.66 0.743 . . . . 0.0 111.636 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ARG . . . . . 0.412 HH21 ' HD2' ' B' ' 65' ' ' LYS . 55.5 ttp180 -56.03 -15.89 4.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.08 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.81 -16.33 36.55 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -94.32 -58.44 2.21 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.656 0.265 . . . . 0.0 110.54 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -97.93 83.35 3.13 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.471 0.653 . . . . 0.0 110.474 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -171.08 -54.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.027 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 54.5 tp -124.14 132.23 53.62 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.58 0.705 . . . . 0.0 110.562 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -102.39 -6.79 22.6 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.507 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 35.3 m80 58.8 15.92 4.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.999 0.428 . . . . 0.0 110.561 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 48.3 m170 47.91 -163.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.702 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -66.94 93.63 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.841 0.353 . . . . 0.0 110.444 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.496 ' CE1' ' C ' ' B' ' 80' ' ' HIS . 46.6 t-80 -71.49 125.96 28.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.404 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 -74.64 -76.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.567 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' HIS . . . . . 0.496 ' C ' ' CE1' ' B' ' 78' ' ' HIS . 44.8 p-80 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.553 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.5 mtp . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -63.93 -59.04 5.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.578 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 49.71 86.91 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.53 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 59.0 mt -66.62 128.64 37.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.115 0.483 . . . . 0.0 110.3 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -98.01 53.55 1.09 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.241 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 30.7 t 50.77 -136.51 1.26 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.561 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.48 ' N ' ' OG ' ' A' ' 6' ' ' SER . 3.0 t -58.79 -55.17 48.88 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-O 118.814 -0.612 . . . . 0.0 109.787 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 71.6 Cg_exo -34.04 -31.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.843 0 C-N-CA 121.633 1.555 . . . . 0.0 113.092 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 7' ' ' VAL . 53.3 t80 -63.65 -43.97 95.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.589 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.4 m-85 -61.59 -43.16 99.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.143 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -64.91 -49.01 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.418 0.628 . . . . 0.0 110.668 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -50.69 -25.11 3.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.401 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -73.65 -38.37 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.03 0.443 . . . . 0.0 110.258 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 44.5 mt -63.26 -39.43 94.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.435 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -59.89 -39.61 85.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.101 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -59.08 -26.8 64.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.531 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -73.97 -52.71 11.95 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.113 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -74.18 -43.66 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.222 0.534 . . . . 0.0 110.706 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 67.5 mm-40 -67.33 -48.18 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.355 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 5.8 ttm -96.79 -161.03 0.84 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.373 0.606 . . . . 0.0 109.939 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -157.46 36.68 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.238 -179.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -53.22 -66.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.997 0.427 . . . . 0.0 110.437 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.1 m -163.59 69.6 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.521 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -159.94 -137.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.49 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -154.97 -168.67 2.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.262 0.553 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -81.21 -105.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.335 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.519 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.6 tt -65.29 -35.93 76.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.455 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 49.3 t-80 -65.44 8.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.749 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -74.43 -43.88 54.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.59 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.3 -44.5 94.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.286 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.59 ' N ' ' SD ' ' A' ' 30' ' ' MET . 10.4 t-20 -52.05 -51.34 58.16 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.955 -0.698 . . . . 0.0 110.676 -178.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.0 t -65.16 -54.18 33.67 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.068 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 54.1 t80 -59.29 -43.64 92.54 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.322 0.582 . . . . 0.0 110.729 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.738 ' CE1' HG21 ' A' ' 38' ' ' VAL . 34.4 t80 -59.57 -56.79 17.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.175 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.608 ' NH2' ' CE2' ' B' ' 63' ' ' TYR . 72.8 ttt-85 -61.17 -28.34 69.06 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.166 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 69.2 m -68.69 -44.71 73.4 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.428 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.4 t -70.89 -55.71 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.285 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.738 HG21 ' CE1' ' A' ' 34' ' ' TYR . 98.1 t -52.93 -45.93 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.382 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.2 m -64.82 -21.86 66.87 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.383 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -86.29 -49.85 7.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.342 0.591 . . . . 0.0 111.018 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.485 HD22 ' NH1' ' A' ' 55' ' ' ARG . 86.5 mt -66.17 -43.58 86.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 42' ' ' VAL . 40.8 t -81.04 24.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.52 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -140.53 1.06 1.71 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.445 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 46' ' ' LEU . 44.9 t0 -146.97 167.33 24.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.318 0.58 . . . . 0.0 110.266 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 65.96 -64.4 0.2 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.55 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 44' ' ' ASP . 18.9 mt 37.66 50.19 1.14 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.193 0.52 . . . . 0.0 111.05 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -78.28 -30.45 48.49 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.694 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 88.2 tttt -174.2 132.76 0.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.365 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -50.26 -41.17 49.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.375 0.607 . . . . 0.0 110.833 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.424 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -62.83 -47.58 82.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.683 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 48.2 t -58.56 -47.42 88.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.269 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.0 t -67.89 -42.48 85.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.36 0.6 . . . . 0.0 110.627 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.9 tp -60.17 -43.14 96.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.399 -178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.77 -38.04 60.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.172 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.485 ' NH1' HD22 ' A' ' 41' ' ' LEU . 60.4 mtp180 -67.44 -41.44 84.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.243 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.454 HD12 HG22 ' A' ' 38' ' ' VAL . 33.7 mm -62.96 -51.1 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.478 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -54.98 -43.84 73.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.673 0.273 . . . . 0.0 110.382 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -68.56 -35.25 77.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.249 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -57.19 -39.78 76.08 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.281 -179.027 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -51.19 -26.88 7.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.886 0.374 . . . . 0.0 110.387 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.41 -38.03 88.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.8 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -53.39 11.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.911 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.01 -42.21 48.81 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.42 0.628 . . . . 0.0 109.935 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -63.95 -30.67 71.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.216 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -63.69 -36.86 85.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.488 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 66.5 t -66.17 -43.92 91.8 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-O 121.933 0.873 . . . . 0.0 110.579 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -63.12 -44.95 94.18 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.109 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -72.14 -12.33 61.14 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.048 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -93.73 -33.28 7.14 Favored Glycine 0 N--CA 1.475 1.299 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -90.84 -33.71 15.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 110.359 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.9 p -140.53 167.41 22.23 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.372 0.606 . . . . 0.0 110.75 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -109.0 -13.57 14.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.693 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 tt 55.74 67.47 1.0 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.224 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -83.39 -88.15 0.1 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.175 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -151.95 147.4 26.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.718 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -147.49 -29.66 0.34 Allowed 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.591 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -65.24 86.99 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.879 0.371 . . . . 0.0 110.503 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.417 ' O ' ' CG ' ' A' ' 79' ' ' HIS . 98.9 m-70 -56.99 -75.8 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.54 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 78' ' ' HIS . 76.6 m80 -155.1 -49.4 0.09 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.584 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.518 -179.962 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' SER . . . . . 0.485 ' O ' ' O ' ' B' ' 3' ' ' GLU . 70.7 m -68.63 -113.74 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.438 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.485 ' O ' ' O ' ' B' ' 2' ' ' SER . 97.7 mt-10 56.72 130.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.482 ' N ' HD12 ' B' ' 4' ' ' LEU . 10.3 mp 52.85 11.01 0.17 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' B' ' 3' ' ' GLU . 75.6 t80 -60.86 -46.24 91.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.492 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -75.22 132.64 41.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.533 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 38.3 t -65.8 -40.89 43.14 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.026 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 71.4 Cg_exo -50.23 -13.26 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 120.821 1.014 . . . . 0.0 112.198 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -73.11 -41.03 64.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 110.59 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -73.21 -46.72 48.81 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.542 -179.809 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.82 -45.86 97.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.647 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -50.19 -20.97 1.15 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.257 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -66.91 -36.53 82.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 0.0 110.519 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -74.18 -35.94 64.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.621 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.38 -40.54 68.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.44 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.3 tt0 -65.44 -35.29 80.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.253 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -63.19 -51.84 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.8 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.4 pt -73.83 -45.81 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.106 0.479 . . . . 0.0 110.747 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' B' ' 18' ' ' ILE . 10.7 tm-20 -67.09 -51.06 59.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.355 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.414 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.1 tpp -91.59 -156.28 0.45 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.5 0.667 . . . . 0.0 110.004 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -164.74 41.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.202 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -57.33 -39.34 75.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.592 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t 174.45 70.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.54 -136.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.44 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -157.16 -159.91 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 110.39 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.444 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 63.2 tttm -91.0 -104.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.291 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.483 ' C ' ' H ' ' B' ' 29' ' ' ALA . 39.0 mm -62.47 -41.37 91.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.287 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' HIS . . . . . 0.645 ' HA ' HD21 ' B' ' 31' ' ' ASN . 61.4 t-80 -62.08 2.18 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.693 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.52 -46.53 54.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.61 0.243 . . . . 0.0 110.663 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.485 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -60.13 -42.64 95.26 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.174 179.494 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.645 HD21 ' HA ' ' B' ' 28' ' ' HIS . 75.2 m-20 -52.02 -50.84 60.6 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.788 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 72.1 m -66.52 -56.16 12.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.962 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 80.7 t80 -56.58 -46.23 80.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.053 0.454 . . . . 0.0 110.605 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.438 ' CB ' ' O ' ' B' ' 30' ' ' MET . 79.5 t80 -57.87 -47.32 83.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.986 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 74.7 ttt-85 -71.16 -24.88 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.337 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 36.4 p -72.59 -47.83 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.46 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.78 -56.95 9.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.591 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -48.98 -45.54 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 69.3 m -60.7 -34.82 74.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.771 0.319 . . . . 0.0 110.304 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.8 m -74.15 -47.84 33.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.196 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.5 -36.12 66.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.21 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -81.55 -31.79 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.294 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -124.12 82.73 2.06 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.549 0.69 . . . . 0.0 110.016 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -170.94 -67.03 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.944 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -102.06 -45.51 5.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.933 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 12.2 mt 44.04 60.82 2.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -92.84 -26.58 17.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.367 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.51 138.41 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.65 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -55.73 -43.1 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.162 0.506 . . . . 0.0 110.549 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.39 -43.06 97.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.92 -35.52 65.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.069 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 49.0 t -78.2 -44.44 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.425 0.631 . . . . 0.0 111.028 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.464 HD23 ' O ' ' B' ' 53' ' ' LEU . 1.1 tt -60.86 -51.99 66.97 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.857 -178.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptmm? -57.08 -39.88 75.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.264 0.554 . . . . 0.0 110.214 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.36 -37.88 88.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.336 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.8 mt -66.91 -46.53 84.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.37 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.87 -37.44 68.81 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.445 ' C ' ' ND1' ' B' ' 58' ' ' HIS . 1.4 t-80 -73.31 -37.35 66.2 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.67 ' O ' HD13 ' B' ' 59' ' ' LEU . 1.1 tm? -62.92 -39.96 96.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.78 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.502 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 50.0 m-20 -50.43 -29.72 10.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.443 ' OE1' ' CD2' ' B' ' 58' ' ' HIS . 3.3 pt-20 -59.86 -33.07 71.31 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.669 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.24 -51.19 26.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.61 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.608 ' CE2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -53.34 -44.13 68.23 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.108 0.48 . . . . 0.0 109.766 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 61.8 m-80 -64.48 -32.44 74.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.1 tptp -60.39 -37.01 79.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.587 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.78 -46.29 94.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.724 0.773 . . . . 0.0 110.318 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.15 -47.19 52.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 122.183 0.992 . . . . 0.0 111.901 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -60.51 -26.1 66.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.139 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.22 -63.7 1.57 Allowed Glycine 0 C--N 1.33 0.213 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' B' ' 71' ' ' SER . 2.1 pp20? -52.91 -173.65 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.719 0.295 . . . . 0.0 110.506 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.477 ' N ' ' OE1' ' B' ' 70' ' ' GLU . 1.0 OUTLIER 77.42 176.81 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.201 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.58 ' C ' HD23 ' B' ' 73' ' ' LEU . 51.6 mtmt 52.21 69.32 0.69 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.607 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.59 ' O ' ' N ' ' B' ' 75' ' ' HIS . 0.9 OUTLIER 34.56 29.57 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.33 0.586 . . . . 0.0 111.338 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' B' ' 72' ' ' LYS . 3.2 pt-20 -27.91 85.25 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.988 0.899 . . . . 0.0 111.193 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.604 ' CD2' ' H ' ' B' ' 76' ' ' HIS . 57.9 t60 -109.62 -133.02 0.33 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.496 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.604 ' H ' ' CD2' ' B' ' 75' ' ' HIS . 36.7 m80 -91.31 112.45 24.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.278 0.561 . . . . 0.0 110.624 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.448 ' O ' ' CG ' ' B' ' 78' ' ' HIS . 75.9 m80 -60.16 -41.97 93.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.385 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.448 ' CG ' ' O ' ' B' ' 77' ' ' HIS . 77.6 m80 -155.45 125.08 6.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.404 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -77.28 114.26 15.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.392 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.4 m -87.43 2.87 49.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.415 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' A' ' 5' ' ' PHE . 74.2 mt-10 -72.76 58.33 0.45 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.954 0.406 . . . . 0.0 110.372 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.8 mm? 52.85 10.78 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.585 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 3' ' ' GLU . 74.7 t80 -68.19 -29.57 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.398 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.83 133.73 44.58 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.312 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.599 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 t -72.5 -38.18 5.02 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.13 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 41.0 Cg_exo -56.35 -22.35 41.08 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 121.565 1.51 . . . . 0.0 111.892 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.46 ' CE1' HD11 ' A' ' 4' ' ' LEU . 39.2 t80 -60.64 -48.15 83.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.828 0.347 . . . . 0.0 110.285 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.75 -37.37 73.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.087 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -67.94 -44.11 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.006 0.431 . . . . 0.0 110.526 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -51.95 -26.41 10.39 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -72.16 -30.92 65.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.968 0.413 . . . . 0.0 110.21 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.458 HD21 ' CD2' ' A' ' 33' ' ' TYR . 50.3 mt -68.83 -38.89 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.701 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.32 -34.13 73.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.091 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -66.33 -29.36 69.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.595 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 47.6 m170 -71.43 -53.52 13.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.78 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.91 -39.45 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.755 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.28 -55.62 31.49 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.809 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.442 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 69.0 mtm -107.51 -62.77 1.38 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.952 0.406 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 8.2 t30 83.56 51.56 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.795 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -48.19 -41.93 28.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.513 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -160.83 65.87 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.593 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.428 ' C ' HD21 ' A' ' 21' ' ' ASN . 20.2 tp10 -158.72 -134.73 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.418 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 73.4 m-20 -148.14 -166.22 2.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.188 0.518 . . . . 0.0 110.363 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -86.09 -110.03 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.543 HD11 ' HD2' ' A' ' 67' ' ' LYS . 17.9 tt -61.29 -33.63 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 120.797 0.332 . . . . 0.0 110.351 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 46.4 t-80 -67.42 2.05 1.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.672 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.48 79.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.562 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.412 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -63.15 -43.86 97.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.89 179.82 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.609 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -66.2 -53.57 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.86 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.458 ' CD2' HD21 ' A' ' 14' ' ' LEU . 64.1 t80 -61.0 -46.34 91.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.614 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.433 ' CE2' HD23 ' A' ' 59' ' ' LEU . 33.8 t80 -58.77 -42.36 88.77 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.487 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -67.4 -31.21 71.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 0.0 110.199 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.9 t -70.94 -42.69 69.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.1 t -67.32 -61.22 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.479 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 39' ' ' SER . 11.8 p -47.94 -40.88 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.074 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 38' ' ' VAL . 58.6 m -54.0 -47.49 71.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 96.3 m -83.67 -32.49 25.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.664 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.2 tt -56.35 -45.01 80.61 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.149 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 42' ' ' VAL . 77.8 t -68.48 -4.92 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.189 0.518 . . . . 0.0 110.529 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -113.94 -39.89 3.86 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.802 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -46.83 -47.86 21.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.337 0.589 . . . . 0.0 110.097 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -103.15 -91.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.276 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 73.2 35.04 0.96 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.986 0.422 . . . . 0.0 110.191 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 t -98.24 -23.84 15.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.735 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -167.04 131.65 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.753 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -52.24 -34.72 47.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.285 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.03 -48.64 57.13 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.944 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -50.82 -42.75 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.693 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -76.28 -31.98 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.612 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.35 -47.56 83.66 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.673 -178.729 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' CE1' ' A' ' 58' ' ' HIS . 2.1 ptpp? -63.36 -40.92 98.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.393 0.616 . . . . 0.0 110.157 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.403 ' N ' ' HG3' ' A' ' 54' ' ' LYS . 16.1 tpp180 -65.29 -43.58 90.71 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.27 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.63 -44.47 99.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -55.09 -31.23 61.05 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.435 ' CE1' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -71.9 -36.5 70.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 18.6 tp -73.56 -29.09 62.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.471 ' O ' ' CD2' ' A' ' 63' ' ' TYR . 90.8 m-20 -52.53 -38.91 60.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.993 0.425 . . . . 0.0 110.322 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -66.84 -18.7 65.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.486 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -67.13 -61.69 1.8 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.019 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.605 ' CD1' ' NH2' ' B' ' 35' ' ' ARG . 1.0 OUTLIER -56.01 -40.41 73.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.884 0.85 . . . . 0.0 110.154 -179.644 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.468 ' N ' ' CG ' ' A' ' 63' ' ' TYR . 52.2 t30 -62.83 -40.27 96.9 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.468 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -58.16 -42.68 86.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.2 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.482 ' O ' ' N ' ' A' ' 70' ' ' GLU . 72.7 t -62.88 -55.65 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.207 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 27' ' ' ILE . 21.0 mtmt -63.15 -43.05 99.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.513 0.673 . . . . 0.0 111.336 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -66.79 -18.89 65.6 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.11 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 70' ' ' GLU . . . -107.86 -13.11 20.93 Favored Glycine 0 N--CA 1.464 0.554 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 66' ' ' VAL . 4.2 mm-40 -47.89 178.19 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.183 0.516 . . . . 0.0 110.657 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.567 ' O ' ' N ' ' A' ' 73' ' ' LEU . 39.1 t -63.6 81.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.471 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mttp 60.93 -66.69 0.05 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.678 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.567 ' N ' ' O ' ' A' ' 71' ' ' SER . 4.8 tp 65.12 43.86 3.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.292 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -68.41 -59.65 3.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.313 0.578 . . . . 0.0 110.458 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.8 m170 53.99 100.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.445 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 61.8 m80 54.45 70.33 0.63 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.539 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -63.29 -42.18 99.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.519 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -164.3 75.84 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.546 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -69.77 131.62 44.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.335 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.662 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 12.3 m 53.01 14.0 0.42 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.583 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -68.99 136.08 51.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.119 0.485 . . . . 0.0 110.224 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.454 ' C ' HD23 ' B' ' 4' ' ' LEU . 4.2 tt -78.55 107.9 11.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.471 0.653 . . . . 0.0 109.975 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -91.26 72.41 6.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.071 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p 46.61 -159.08 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 3.2 t -55.24 -54.97 44.62 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 118.903 -0.57 . . . . 0.0 109.808 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 52.3 Cg_exo -34.3 -27.5 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.009 0 C-N-CA 121.7 1.6 . . . . 0.0 113.124 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 7' ' ' VAL . 57.5 t80 -58.35 -37.77 75.84 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.304 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -61.78 -43.18 99.36 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.5 -46.95 82.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.84 0.828 . . . . 0.0 110.738 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -49.32 -23.14 1.29 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.63 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ASN . . . . . 0.414 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 18.5 m120 -74.93 -36.09 62.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.517 0.675 . . . . 0.0 110.595 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' B' ' 14' ' ' LEU . 16.4 mt -69.13 -38.51 78.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.34 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -54.15 -39.98 67.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.165 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -70.71 -31.81 68.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.238 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.469 ' O ' ' ND2' ' B' ' 21' ' ' ASN . 43.2 m170 -66.74 -50.41 62.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.704 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.3 pt -72.93 -36.16 50.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.329 0.585 . . . . 0.0 110.656 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -77.39 -54.65 6.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.069 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 18.8 tpp -81.77 -58.65 2.9 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.257 0.551 . . . . 0.0 110.54 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 17' ' ' HIS . 3.1 m120 69.5 36.76 2.13 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.866 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -60.28 -38.65 84.23 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.276 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.1 m -152.22 60.07 0.84 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.742 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -166.7 -133.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.139 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -158.44 -168.58 2.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.407 0.623 . . . . 0.0 110.358 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -85.8 -104.23 0.06 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.277 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.454 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.4 mm -61.31 -37.34 77.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -64.42 3.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.882 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.454 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.78 -46.81 51.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.828 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.407 ' O ' ' CB ' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -62.5 -50.84 69.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.948 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -58.75 -48.04 82.57 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.447 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -65.34 -53.79 38.54 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.546 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 39.5 t80 -60.11 -53.14 61.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.078 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.414 ' O ' HG22 ' B' ' 38' ' ' VAL . 55.1 t80 -53.44 -42.06 66.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.605 ' NH2' ' CD1' ' A' ' 63' ' ' TYR . 73.0 ttt-85 -68.55 -35.17 77.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.2 t -64.6 -43.0 95.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.486 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.47 ' O ' ' N ' ' B' ' 41' ' ' LEU . 62.2 t -67.1 -65.35 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.594 HG23 ' N ' ' B' ' 39' ' ' SER . 29.9 m -47.64 -49.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.7 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.594 ' N ' HG23 ' B' ' 38' ' ' VAL . 34.2 p -47.48 -61.09 2.09 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 119.994 -0.682 . . . . 0.0 111.401 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -74.62 -44.18 51.84 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.273 1.035 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.47 ' N ' ' O ' ' B' ' 37' ' ' VAL . 51.3 tp -57.31 -34.44 68.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.579 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 38' ' ' VAL . 53.6 t -75.65 -2.28 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.9 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.58 41.04 0.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.401 -179.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -99.12 -59.45 1.72 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.101 0.477 . . . . 0.0 110.389 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -113.19 -31.97 6.45 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.528 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 tt 48.79 68.02 0.77 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.257 0.551 . . . . 0.0 110.163 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.2 t -96.49 -25.34 15.69 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.298 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -180.0 140.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.688 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -61.97 -44.77 96.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.76 86.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 9.0 t -57.93 -62.04 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.704 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 25.5 m -54.03 -33.82 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.434 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -61.72 2.21 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.048 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.32 -34.67 64.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.206 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -65.34 -39.57 92.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 86.5 mt -67.65 -49.97 65.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.335 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -56.52 -38.28 71.63 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.479 ' CE1' ' OE1' ' B' ' 61' ' ' GLU . 34.0 t60 -69.78 -43.29 72.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.32 -27.5 47.49 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.488 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -53.29 -36.71 61.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.435 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.479 ' OE1' ' CE1' ' B' ' 58' ' ' HIS . 5.8 pt-20 -57.72 -31.27 66.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.387 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.43 -58.13 4.05 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.79 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.3 -40.71 49.37 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.032 0.444 . . . . 0.0 109.933 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -68.98 -36.62 78.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.578 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -65.05 -35.77 82.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.616 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 77.6 t -57.24 -52.92 50.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.09 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -69.69 -38.4 76.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.012 0.911 . . . . 0.0 111.664 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -40.85 -32.84 0.25 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.394 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.93 -44.76 5.91 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.3 152.4 43.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.056 0.455 . . . . 0.0 110.035 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.587 ' O ' ' N ' ' B' ' 73' ' ' LEU . 22.9 t -166.59 36.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.288 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt 60.67 -42.47 0.11 Allowed 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.651 0.738 . . . . 0.0 111.511 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' B' ' 71' ' ' SER . 86.8 mt -67.92 -34.03 75.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.362 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' B' ' 76' ' ' HIS . 76.2 mm-40 53.17 64.5 1.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.313 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -62.61 81.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.389 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.435 ' O ' ' N ' ' B' ' 78' ' ' HIS . 69.4 m80 -63.96 -44.58 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.32 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 43.1 m170 48.14 -92.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.552 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' B' ' 76' ' ' HIS . 83.0 t60 48.42 71.82 0.33 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.626 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 52.83 79.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.658 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' B' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.627 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mmm . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.411 ' OG ' ' N ' ' A' ' 3' ' ' GLU . 26.5 t 53.22 -152.57 0.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.739 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.411 ' N ' ' OG ' ' A' ' 2' ' ' SER . 42.6 tt0 -159.27 90.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.624 0.726 . . . . 0.0 110.68 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -87.02 6.17 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -56.47 -43.74 79.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.197 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -64.29 131.43 47.3 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.023 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.585 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.9 t -65.84 -40.47 39.32 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.124 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 49.9 Cg_exo -54.19 -26.61 43.19 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 121.79 1.66 . . . . 0.0 112.066 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.19 -41.05 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.281 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.432 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.6 m-85 -60.38 -39.39 87.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.364 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.3 mt -67.79 -45.27 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.979 0.419 . . . . 0.0 110.461 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -48.2 -23.99 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.529 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -74.48 -33.79 62.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 110.685 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.58 -37.51 68.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.314 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -57.26 -41.08 79.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.993 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -67.95 -31.29 70.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.543 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -66.17 -50.69 63.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.819 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 pt -70.92 -39.94 75.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.25 0.548 . . . . 0.0 110.83 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -57.59 -53.86 53.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.252 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 72.8 mtm -114.49 -118.82 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.404 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -171.67 61.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.377 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -73.41 50.35 0.31 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 122.105 0.955 . . . . 0.0 110.96 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 76.79 55.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.136 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -156.51 -134.68 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.21 0.528 . . . . 0.0 110.614 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -159.38 -169.29 2.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.21 -179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.7 tttm -80.71 -105.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.356 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.456 ' C ' ' H ' ' A' ' 29' ' ' ALA . 6.9 tt -65.71 -31.12 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.53 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -69.86 10.33 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.557 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.56 -45.18 22.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.358 0.599 . . . . 0.0 110.872 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.9 ptm -62.01 -50.76 70.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.401 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -53.61 -46.91 70.59 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.397 -178.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -67.05 -53.6 29.59 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.055 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.432 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 47.4 t80 -62.4 -49.63 74.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.385 0.612 . . . . 0.0 110.99 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.507 ' N ' ' O ' ' A' ' 30' ' ' MET . 75.9 t80 -54.56 -47.94 72.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.07 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -65.25 -38.1 89.29 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.4 p -59.89 -43.41 94.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.401 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 98.0 t -70.89 -49.55 49.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.468 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.6 -49.25 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.396 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.8 t -59.02 -35.92 74.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.817 0.341 . . . . 0.0 110.452 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 90.1 m -71.66 -49.77 36.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.412 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -49.74 -34.26 18.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -86.21 -33.48 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.5 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 44' ' ' ASP . 84.3 mt-30 -111.33 81.63 1.47 Allowed 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.989 0.9 . . . . 0.0 109.736 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.458 ' CB ' ' O ' ' A' ' 43' ' ' GLN . 3.6 t70 156.94 136.44 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.204 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.431 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 56.4 tt0 69.21 -62.23 0.41 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt 45.56 70.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.058 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -101.25 -28.9 12.39 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.302 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HE3' ' HB3' ' A' ' 50' ' ' ALA . 34.5 ttpt -178.17 144.83 0.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.232 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -60.91 -41.96 97.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' HE3' ' A' ' 48' ' ' LYS . . . -58.37 -46.18 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.982 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.4 -64.86 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.74 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 53' ' ' LEU . 31.9 m -53.8 -39.69 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.602 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.432 ' N ' HG23 ' A' ' 52' ' ' VAL . 57.4 tp -60.43 -52.27 65.94 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.733 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 49.5 mtpt -52.07 -37.02 52.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.568 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -66.48 -34.28 77.59 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.181 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.7 mt -71.81 -52.77 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.779 -0.369 . . . . 0.0 110.354 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -58.76 -32.98 69.77 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.141 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.4 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -77.12 -46.91 21.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.6 tp -52.23 -27.16 13.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.44 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -51.26 -38.35 52.21 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.397 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -54.71 -33.02 60.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.588 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.49 16.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.549 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.461 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.29 -44.81 68.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.141 0.496 . . . . 0.0 110.318 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -65.83 -35.56 81.02 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.961 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.32 -40.01 94.93 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.416 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.65 -48.81 86.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.455 0.645 . . . . 0.0 110.467 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -44.14 92.38 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.414 1.102 . . . . 0.0 111.698 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -55.77 -27.67 52.15 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.63 -8.5 84.58 Favored Glycine 0 CA--C 1.518 0.262 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 61.6 mm-40 -122.44 -135.88 0.3 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 72' ' ' LYS . 5.5 p 69.42 -63.12 0.39 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 122.371 1.081 . . . . 0.0 110.674 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.509 ' N ' ' OG ' ' A' ' 71' ' ' SER . 71.8 mmtt 72.4 113.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.24 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 46.9 mt 60.95 -136.86 0.6 Allowed 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.767 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 53.86 73.7 0.37 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.118 0.485 . . . . 0.0 110.474 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -102.07 23.65 11.25 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.391 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.474 ' CD2' ' O ' ' A' ' 78' ' ' HIS . 4.1 t60 -138.93 134.34 33.05 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.162 0.506 . . . . 0.0 110.749 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -62.92 -88.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.681 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.474 ' O ' ' CD2' ' A' ' 76' ' ' HIS . 54.5 t-80 -72.93 150.25 42.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.523 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.414 ' CG ' ' N ' ' A' ' 80' ' ' HIS . 84.6 t60 -71.0 160.26 33.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.487 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' N ' ' CG ' ' A' ' 79' ' ' HIS . 59.3 t-80 . . . . . 0 C--O 1.219 -0.53 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.627 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 78.4 p -67.33 -16.96 64.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.37 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -53.84 153.54 4.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.626 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.442 ' CD1' ' CD1' ' B' ' 9' ' ' TYR . 4.3 mm? -46.4 114.37 0.8 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.751 0.786 . . . . 0.0 110.417 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -73.64 64.47 0.9 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.747 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 43.7 t 55.6 -163.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.739 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.486 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.7 t -57.4 -54.92 49.8 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.148 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 50.2 Cg_exo -35.06 -29.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.117 1.878 . . . . 0.0 113.081 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' TYR . . . . . 0.472 ' N ' ' O ' ' B' ' 7' ' ' VAL . 41.0 t80 -56.22 -41.85 76.3 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.018 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.403 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.8 m-85 -62.11 -40.23 95.18 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 36.3 mt -64.86 -48.78 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 121.295 0.569 . . . . 0.0 110.343 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.85 -26.49 35.71 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.311 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -69.49 -35.57 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.872 0.368 . . . . 0.0 110.235 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.516 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -68.3 -36.92 80.08 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.635 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -56.42 -32.54 64.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.033 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' B' ' 20' ' ' MET . 1.9 pt20 -67.25 -35.06 78.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.378 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -65.33 -50.74 64.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.505 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.8 pt -73.36 -41.73 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.564 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -72.07 -53.77 11.86 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.428 ' N ' ' O ' ' B' ' 16' ' ' GLN . 24.8 ttm -86.47 -69.06 0.7 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.106 0.479 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' B' ' 25' ' ' ASP . 43.2 t30 74.93 45.03 0.16 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.706 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -40.04 -34.35 0.28 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.461 0.648 . . . . 0.0 111.097 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.1 p -167.09 -20.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.659 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -61.42 -132.52 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.917 0.389 . . . . 0.0 110.593 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 69.1 m-20 -155.79 -166.29 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.351 0.596 . . . . 0.0 110.099 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.41 -101.81 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.793 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.7 mm -65.66 -39.69 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.186 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' HIS . . . . . 0.472 ' CD2' ' O ' ' B' ' 28' ' ' HIS . 73.2 t60 -65.64 11.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.278 . . . . 0.0 110.508 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.92 -49.25 18.35 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.938 0.399 . . . . 0.0 110.475 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.594 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -58.01 -39.93 79.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.258 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.565 ' N ' ' SD ' ' B' ' 30' ' ' MET . 93.2 m-20 -49.75 -40.4 40.91 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 22.3 t -80.12 -55.92 4.59 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.619 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.516 ' CD1' HD21 ' B' ' 14' ' ' LEU . 63.4 t80 -58.18 -46.6 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.085 0.469 . . . . 0.0 110.887 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.594 ' N ' ' O ' ' B' ' 30' ' ' MET . 28.9 t80 -57.22 -51.52 68.99 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.897 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 74.9 ttt180 -67.08 -25.94 66.48 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.7 m -70.9 -46.95 61.64 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.566 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' B' ' 40' ' ' THR . 77.8 t -64.95 -65.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.63 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.596 HG23 ' N ' ' B' ' 39' ' ' SER . 23.6 m -45.69 -46.23 4.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.537 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.596 ' N ' HG23 ' B' ' 38' ' ' VAL . 42.0 t -59.67 -26.58 65.66 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' THR . . . . . 0.458 ' O ' ' N ' ' B' ' 44' ' ' ASP . 28.9 m -85.22 -51.12 6.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.779 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.88 -45.05 91.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.78 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 38' ' ' VAL . 69.7 t -58.23 -22.1 18.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.078 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -103.8 -26.79 12.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.577 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' B' ' 40' ' ' THR . 51.3 t0 -56.74 -47.4 80.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.207 0.527 . . . . 0.0 110.766 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -133.38 -167.09 1.87 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.313 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 179.1 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.578 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.438 HG22 ' H ' ' B' ' 47' ' ' THR . 0.0 OUTLIER -62.91 -45.49 92.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.264 0.554 . . . . 0.0 110.284 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -156.89 133.0 9.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 42.6 m-20 -50.24 -25.3 3.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.617 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.612 ' C ' ' HZ2' ' B' ' 54' ' ' LYS . . . -78.16 -53.4 7.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.075 0.464 . . . . 0.0 110.948 179.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 23.3 t -46.04 -39.52 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.286 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -77.05 -32.01 19.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.25 0.547 . . . . 0.0 110.599 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 tp -59.95 -29.83 68.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.259 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.612 ' HZ2' ' C ' ' B' ' 50' ' ' ALA . 28.5 mmtm -62.03 -46.7 88.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.453 0.644 . . . . 0.0 110.525 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -64.95 -42.74 94.36 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.399 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 78.4 mt -62.8 -50.1 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.451 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -54.33 -35.76 63.04 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.411 ' O ' ' HG2' ' B' ' 61' ' ' GLU . 36.3 m170 -72.36 -22.3 61.17 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' B' ' 59' ' ' LEU . 0.2 OUTLIER -76.42 -23.97 53.98 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.347 179.611 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.4 -41.67 98.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.452 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' B' ' 58' ' ' HIS . 7.9 pt-20 -61.77 -31.47 71.67 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.947 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.93 -57.86 4.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.532 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -42.97 55.9 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 110.212 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -63.43 -33.72 76.17 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.765 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -64.4 -38.1 89.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.441 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.01 -48.33 89.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.464 0.65 . . . . 0.0 110.4 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -48.21 50.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.211 1.005 . . . . 0.0 111.692 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -59.46 -35.17 73.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.106 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.44 -16.56 75.68 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -97.1 -171.32 2.19 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.047 0.451 . . . . 0.0 110.583 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 37.3 t -166.01 166.67 17.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.252 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -74.44 -55.49 5.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.534 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' B' ' 75' ' ' HIS . 2.2 pp -155.39 -26.79 0.11 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.016 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -50.44 89.21 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.918 0.866 . . . . 0.0 109.984 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' B' ' 73' ' ' LEU . 47.2 t-80 60.23 72.49 0.52 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.297 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -157.45 76.59 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.632 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -146.06 156.95 43.82 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.449 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -69.65 128.84 37.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.385 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -77.4 140.15 39.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.409 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.1 -0.952 . . . . 0.0 110.763 -179.975 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 t 69.03 -56.32 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.522 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 52.9 91.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.43 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER -170.67 -21.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.552 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -62.48 -45.65 92.04 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.227 0.537 . . . . 0.0 110.218 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -76.03 131.76 39.71 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.234 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.654 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 57.2 t -65.04 -48.25 71.36 Favored Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 9.0 Cg_endo -47.34 -23.64 3.35 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 121.636 1.557 . . . . 0.0 112.296 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -62.32 -43.69 98.24 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.04 0.448 . . . . 0.0 110.491 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -61.4 -41.93 97.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.103 -179.835 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.4 mt -60.27 -44.2 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.288 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -52.12 -23.95 6.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.753 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -66.58 -38.4 86.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.51 -36.94 65.82 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.812 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptt -52.95 -32.99 48.97 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.143 0.497 . . . . 0.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.5 tt0 -68.95 -33.67 74.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.603 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -63.57 -51.86 63.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.616 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.401 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 9.0 pt -73.96 -45.48 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.291 0.567 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.1 tt0 -67.61 -38.87 84.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.263 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.422 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 5.7 ttm -111.04 -164.07 0.89 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.596 0.713 . . . . 0.0 110.253 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -154.83 45.36 0.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.36 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -56.55 -46.01 80.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.129 0.49 . . . . 0.0 110.408 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t 176.81 67.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.397 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -161.35 -133.72 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 110.358 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -156.69 -168.67 2.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.185 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 60.9 tttp -80.34 -104.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.552 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.7 tt -64.86 -35.46 75.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.65 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -67.44 12.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.623 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -77.93 -45.73 23.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.118 0.485 . . . . 0.0 110.585 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -61.06 -43.94 98.12 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.526 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' A' ' 30' ' ' MET . 26.4 t-20 -50.25 -40.33 47.52 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.493 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -78.59 -55.42 5.21 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.755 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 78.8 t80 -59.49 -48.92 79.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.188 0.518 . . . . 0.0 110.681 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.655 ' O ' HG23 ' A' ' 38' ' ' VAL . 64.7 t80 -54.56 -44.39 72.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.859 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -71.28 -28.02 63.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.9 m -70.03 -48.02 59.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.037 0.446 . . . . 0.0 110.711 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -71.26 -45.26 71.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.466 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.2 t -55.26 -42.48 66.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.29 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.5 p -64.5 -25.9 68.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.78 0.324 . . . . 0.0 110.498 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 94.4 m -84.21 -45.69 12.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.718 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.468 HD22 ' HG2' ' A' ' 55' ' ' ARG . 92.8 mt -58.92 -43.06 91.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.867 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 p -70.79 -27.37 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 121.463 0.649 . . . . 0.0 110.931 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.529 ' O ' ' C ' ' A' ' 44' ' ' ASP . 33.5 mt-30 -86.04 -28.44 24.14 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.629 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.529 ' C ' ' O ' ' A' ' 43' ' ' GLN . 77.0 m-20 -24.96 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 47' ' ' THR . 23.1 pt20 -156.55 7.68 0.2 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.051 0.453 . . . . 0.0 110.627 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.477 ' C ' ' O ' ' A' ' 45' ' ' GLN . 1.0 OUTLIER 27.93 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.486 0.66 . . . . 0.0 111.075 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 45' ' ' GLN . 9.8 t -60.53 -29.92 69.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.588 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -157.99 126.31 5.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.58 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 17.1 p30 -46.74 -35.82 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.198 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.68 70.37 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.888 0.375 . . . . 0.0 110.697 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.56 -45.07 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.642 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.35 -41.16 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.114 0.483 . . . . 0.0 110.925 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.68 -48.52 74.44 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.052 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.42 -43.58 93.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.802 0.81 . . . . 0.0 110.411 -178.936 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.468 ' HG2' HD22 ' A' ' 41' ' ' LEU . 19.5 tpt85 -63.35 -37.03 85.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.129 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.25 -45.18 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.419 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -57.99 -36.62 72.89 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.381 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.6 m170 -72.63 -43.5 63.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.34 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -53.56 -30.43 41.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.748 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -51.77 -29.2 17.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -60.96 -32.51 72.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.3 -56.56 5.78 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.729 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -44.99 66.36 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.976 0.417 . . . . 0.0 110.121 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.74 -35.53 80.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.0 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -57.34 -42.78 82.61 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.457 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.8 -49.68 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 121.536 0.684 . . . . 0.0 110.484 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.97 -43.38 92.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.82 0.819 . . . . 0.0 111.523 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.05 -23.3 63.63 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.109 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.41 -17.85 20.73 Favored Glycine 0 N--CA 1.465 0.597 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 5.8 mm-40 -107.61 169.29 8.68 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.354 0.597 . . . . 0.0 110.323 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p 45.52 92.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -67.9 -95.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.483 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.521 ' N ' HD12 ' A' ' 73' ' ' LEU . 9.5 mp -74.09 147.87 42.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 0.0 109.916 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.05 54.76 1.79 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.212 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -66.81 -65.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.292 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.488 ' CG ' ' N ' ' A' ' 77' ' ' HIS . 23.6 t-80 51.51 -109.38 0.43 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.516 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' ' CG ' ' A' ' 76' ' ' HIS . 63.9 t-80 -72.42 128.11 34.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.035 0.445 . . . . 0.0 110.38 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -90.44 119.43 30.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.299 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.457 ' O ' ' CG ' ' A' ' 80' ' ' HIS . 99.0 m-70 -60.91 -69.55 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.591 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 79' ' ' HIS . 74.0 m80 . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.448 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.492 ' SD ' ' N ' ' B' ' 1' ' ' MET . 4.4 mpp? . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 35.2 t -167.56 9.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.371 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' B' ' 3' ' ' GLU . 1.3 pm0 -158.63 77.4 0.76 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.613 0.721 . . . . 0.0 110.845 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.97 27.27 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.148 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -59.61 -47.3 86.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 120.959 0.409 . . . . 0.0 109.931 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.47 131.15 38.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.161 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.632 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -55.77 -50.53 86.6 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.807 178.65 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.632 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 5.7 Cg_endo -44.62 -17.49 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.987 1.792 . . . . 0.0 112.217 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' TYR . . . . . 0.437 ' N ' ' O ' ' B' ' 7' ' ' VAL . 81.0 t80 -69.28 -43.01 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.154 0.502 . . . . 0.0 110.433 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -68.21 -46.09 71.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.659 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' B' ' 14' ' ' LEU . 40.6 mt -62.8 -43.61 98.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.086 0.47 . . . . 0.0 110.29 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -46.34 -21.96 0.21 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.205 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ASN . . . . . 0.416 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 46.4 m-20 -73.03 -39.29 66.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.905 0.383 . . . . 0.0 110.363 179.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.611 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.3 mp -71.13 -37.01 72.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.64 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -55.98 -42.31 76.1 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.323 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -66.92 -31.63 72.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.416 ' CD2' ' O ' ' B' ' 13' ' ' ASN . 45.1 m170 -66.98 -51.73 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.156 0.503 . . . . 0.0 110.672 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.1 pt -74.11 -43.69 51.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.833 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.7 -53.61 21.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 8.5 tpp -88.15 -157.87 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.5 0.666 . . . . 0.0 109.992 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -157.74 46.28 0.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.321 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -63.03 -51.98 64.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.252 0.549 . . . . 0.0 110.497 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.7 p -174.91 72.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -166.52 -136.2 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.991 0.424 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -157.44 -158.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 64.1 tttm -94.91 -103.01 0.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.431 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 1.6 mm -61.59 -36.71 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.64 4.86 2.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.613 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.98 -50.24 20.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.723 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.543 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -61.46 -43.52 98.73 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.253 179.486 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.543 ' N ' ' SD ' ' B' ' 30' ' ' MET . 75.0 m-20 -53.71 -48.46 69.55 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.587 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -66.91 -53.22 34.16 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.818 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 57.0 t80 -61.79 -50.06 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.26 0.553 . . . . 0.0 110.849 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.642 ' O ' HG23 ' B' ' 38' ' ' VAL . 75.1 t80 -54.71 -45.52 74.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.722 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -68.62 -37.0 79.4 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.617 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 55.2 m -61.96 -44.18 97.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.217 0.532 . . . . 0.0 110.772 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.7 t -72.05 -46.27 59.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.597 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 34' ' ' TYR . 38.0 t -50.47 -44.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.351 -179.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 10.7 t -63.39 -34.64 78.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.191 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -72.61 -49.92 28.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.143 0.497 . . . . 0.0 110.936 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.441 ' CD2' ' NH2' ' B' ' 55' ' ' ARG . 97.3 mt -50.91 -34.93 30.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.948 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.5 t -87.77 -32.81 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.441 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -119.72 82.58 1.91 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.527 0.68 . . . . 0.0 110.176 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -167.64 -71.22 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.998 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.46 HE21 HG22 ' B' ' 47' ' ' THR . 18.6 pt20 -105.54 -38.35 6.48 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.342 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 tp 37.85 54.19 1.56 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.787 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.46 HG22 HE21 ' B' ' 45' ' ' GLN . 2.5 t -83.89 -24.79 30.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.405 ' O ' HG23 ' B' ' 52' ' ' VAL . 35.6 tptt -173.78 138.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.751 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -54.59 -46.15 73.71 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.808 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.66 -45.7 88.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.432 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.67 -34.34 47.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.005 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 48' ' ' LYS . 39.3 t -81.89 -45.07 20.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.591 0.71 . . . . 0.0 111.1 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -52.35 65.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.907 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.437 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.2 pttp -53.36 -40.58 65.06 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.441 ' NH2' ' CD2' ' B' ' 41' ' ' LEU . 77.3 mtp180 -68.34 -37.28 80.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.118 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 4.3 mm -64.38 -50.65 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.459 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -61.39 -37.22 82.61 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.255 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.496 ' CE1' ' OE2' ' B' ' 61' ' ' GLU . 5.7 t-80 -67.55 -46.98 71.16 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.888 0.375 . . . . 0.0 110.233 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.7 tp -49.88 -30.43 10.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.685 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -52.21 -30.83 29.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.7 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.496 ' OE2' ' CE1' ' B' ' 58' ' ' HIS . 9.5 pt-20 -58.1 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.602 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.43 -53.47 28.83 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.836 0.35 . . . . 0.0 110.475 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -46.28 72.04 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 110.193 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -63.75 -36.67 84.65 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.315 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 30.5 tptt -60.26 -33.6 72.53 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.61 -43.15 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 122.028 0.918 . . . . 0.0 110.515 -178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.406 ' HZ3' ' HB3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -69.0 -44.77 72.13 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.655 -179.116 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 87.2 mtm180 -66.82 -21.93 66.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.336 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.443 ' O ' ' N ' ' B' ' 72' ' ' LYS . . . -89.69 -70.1 1.24 Allowed Glycine 0 N--CA 1.463 0.453 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' B' ' 26' ' ' LYS . 2.7 pp20? -37.82 -38.82 0.31 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.686 0.755 . . . . 0.0 111.464 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.403 ' N ' ' CD ' ' B' ' 70' ' ' GLU . 74.2 m -50.53 -38.98 47.69 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.013 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.443 ' N ' ' O ' ' B' ' 69' ' ' GLY . 68.8 mttm -134.47 -163.04 1.31 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.069 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.4 tp 48.89 70.2 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.641 -179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -111.9 -2.67 15.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.54 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 55.7 t-80 54.23 12.28 0.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.901 0.382 . . . . 0.0 110.438 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.491 ' ND1' ' N ' ' B' ' 76' ' ' HIS . 0.3 OUTLIER -72.95 134.33 44.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.395 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 47.99 92.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.74 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 27.0 t-80 -160.26 141.75 12.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.47 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -59.45 -44.77 92.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.52 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 85.0 t60 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.696 179.962 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -139.76 149.38 43.5 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.443 ' OE1' ' N ' ' A' ' 3' ' ' GLU . 40.1 mp0 -90.14 111.09 22.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.638 0.732 . . . . 0.0 110.325 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.77 12.57 33.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.248 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.19 -45.29 87.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.936 0.398 . . . . 0.0 110.159 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.7 137.88 44.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.18 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.577 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -67.66 -41.8 32.16 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.868 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 52.4 Cg_exo -52.85 -24.82 25.25 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.02 1.814 . . . . 0.0 111.92 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -61.62 -47.2 86.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.842 0.353 . . . . 0.0 110.331 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.448 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 2.9 m-85 -59.41 -40.47 86.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.293 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.9 mt -64.71 -43.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-O 121.032 0.444 . . . . 0.0 110.295 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -52.02 -25.76 9.23 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.735 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -73.21 -35.46 66.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.269 0.557 . . . . 0.0 110.621 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.0 mt -70.55 -37.37 74.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.323 -179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -52.28 -39.67 60.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.069 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.01 -31.86 73.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.586 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.32 -51.95 46.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.697 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 10.9 pt -72.95 -44.32 57.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 80.4 tt0 -53.94 -55.34 27.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.45 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 58.2 mtm -113.11 -133.34 0.34 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.921 0.391 . . . . 0.0 110.202 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p30 -171.48 52.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.332 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.489 ' NE2' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -54.74 -45.08 74.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.491 -179.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -174.56 62.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -166.17 -133.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.399 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -157.39 -162.95 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 110.325 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.406 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 64.2 tttm -83.44 -104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.356 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.528 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.8 mt -66.11 -37.42 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -63.69 6.47 0.15 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.612 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.528 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.16 -45.8 22.28 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.466 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.61 -44.85 95.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.479 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.573 ' N ' ' SD ' ' A' ' 30' ' ' MET . 39.2 t30 -51.63 -50.69 59.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.557 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.0 m -65.51 -53.38 43.15 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.633 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.448 ' OH ' ' CD1' ' A' ' 10' ' ' PHE . 4.9 t80 -61.46 -23.46 65.89 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.368 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 30' ' ' MET . 82.8 t80 -76.74 -57.61 3.76 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.376 0.608 . . . . 0.0 110.953 -178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -23.81 66.84 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.979 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.0 p -71.2 -49.88 38.91 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.541 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 79.8 t -70.8 -56.35 11.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.934 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.2 t -49.97 -48.04 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.501 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.2 m -54.96 -52.29 63.5 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.798 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.0 m -68.92 -44.17 73.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.754 0.788 . . . . 0.0 110.981 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -59.72 -40.69 88.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.432 -178.784 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 42' ' ' VAL . 26.5 t -96.0 26.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.106 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -165.9 27.77 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -154.54 17.48 0.46 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.705 0.288 . . . . 0.0 110.541 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.407 ' HG2' ' H ' ' A' ' 47' ' ' THR . 57.1 tt0 -153.38 -77.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.359 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.8 tp 59.41 41.41 19.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 110.642 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 33.8 m -70.85 -40.49 72.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.51 0.671 . . . . 0.0 110.966 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 63.7 tttp -175.53 143.15 0.61 Allowed 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.627 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' HB2' ' B' ' 50' ' ' ALA . 65.7 m-20 -50.08 -45.93 52.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.724 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.4 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -64.07 -46.91 82.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.706 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 49.9 t -57.02 -47.23 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.863 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.557 HG23 ' N ' ' A' ' 53' ' ' LEU . 15.9 m -76.55 -46.65 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.66 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.557 ' N ' HG23 ' A' ' 52' ' ' VAL . 60.0 tp -51.3 -58.6 5.76 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.884 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.472 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 17.5 pttm -50.5 -35.63 30.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.851 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 tpt85 -66.34 -44.7 82.54 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.199 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 50.6 mm -63.57 -52.51 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.487 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -56.61 -39.4 73.54 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.472 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -68.99 -44.0 73.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.273 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 tp -60.2 -33.68 72.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.87 0.367 . . . . 0.0 110.434 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -51.4 -39.55 57.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.541 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.75 -29.16 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.11 -54.0 21.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.773 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.7 -43.06 72.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.158 0.504 . . . . 0.0 110.118 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -66.07 -37.37 85.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.621 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.5 mmpt? -62.0 -34.58 76.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.239 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.58 -46.04 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.363 0.602 . . . . 0.0 110.153 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -67.96 -42.84 80.27 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.497 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -80.67 -10.41 59.73 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.151 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -97.66 -26.12 10.15 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.436 ' OE2' HD11 ' A' ' 27' ' ' ILE . 1.5 pp20? -88.17 -31.69 19.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.893 0.377 . . . . 0.0 110.329 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 72' ' ' LYS . 40.4 t -106.87 -167.79 1.33 Allowed 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.246 0.546 . . . . 0.0 110.579 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.48 ' N ' ' OG ' ' A' ' 71' ' ' SER . 1.3 ptpp? -159.68 69.17 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.462 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.8 tp 55.71 64.7 1.66 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.553 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -148.91 98.37 2.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.368 0.604 . . . . 0.0 110.127 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.446 ' O ' ' O ' ' A' ' 76' ' ' HIS . 25.6 p80 -168.34 134.46 1.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.468 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.446 ' O ' ' O ' ' A' ' 75' ' ' HIS . 1.6 t60 56.15 116.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.769 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -56.18 -42.32 76.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.429 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 53.37 103.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.542 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -64.75 135.43 55.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.504 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.605 -179.912 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 84.1 mtp . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 26.0 t 52.25 98.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.628 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -154.01 159.8 41.76 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.559 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.406 ' C ' HD23 ' B' ' 4' ' ' LEU . 1.9 tt -70.86 103.12 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.407 0.622 . . . . 0.0 110.158 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -102.25 78.6 1.77 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.107 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.452 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 46.6 t 53.35 -164.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.845 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.9 t -56.01 -55.59 39.84 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 46.6 Cg_exo -34.82 -26.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.052 1.835 . . . . 0.0 113.126 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 7' ' ' VAL . 89.8 t80 -56.65 -40.07 74.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.356 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.23 -45.39 91.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.072 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.57 -43.99 83.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.319 0.581 . . . . 0.0 110.384 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -50.59 -25.86 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.507 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -76.08 -34.54 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.246 0.546 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.8 mt -73.25 -40.03 64.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.537 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.42 -37.11 74.69 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.997 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.424 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.4 tt0 -66.59 -41.43 88.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -59.08 -49.55 77.45 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.858 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.8 pt -73.31 -40.67 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.618 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -72.06 -60.42 2.24 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.144 -0.623 . . . . 0.0 110.964 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.53 ' SD ' ' N ' ' B' ' 20' ' ' MET . 0.0 OUTLIER -81.43 -66.29 0.91 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 25.1 t30 75.46 46.84 0.11 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -54.32 -41.35 68.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.008 0.432 . . . . 0.0 110.583 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 38.2 t -161.63 66.09 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.601 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLU . . . . . 0.443 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 29.2 tp10 -158.03 -127.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.394 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -160.68 -172.41 3.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.239 0.543 . . . . 0.0 110.109 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -83.38 -103.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.288 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.04 -34.11 64.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.738 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -64.57 -5.56 5.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.28 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.6 -49.95 71.35 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.969 0.414 . . . . 0.0 110.682 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.533 ' O ' ' N ' ' B' ' 34' ' ' TYR . 12.2 tmm? -56.45 -48.35 77.25 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.797 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -52.83 -39.47 62.5 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.388 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.443 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 7.9 t -73.36 -54.5 8.17 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.116 -0.633 . . . . 0.0 110.773 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.409 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 38.0 t80 -63.08 -25.07 68.2 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.082 0.467 . . . . 0.0 110.973 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.721 ' O ' HG23 ' B' ' 38' ' ' VAL . 29.7 t80 -72.82 -51.27 19.55 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.367 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.532 HH22 ' CG ' ' A' ' 31' ' ' ASN . 19.7 ptp180 -72.48 -20.52 61.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.54 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.8 t -70.8 -54.25 12.34 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.71 -178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.511 HG23 ' N ' ' B' ' 38' ' ' VAL . 30.2 m -69.04 -43.39 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.35 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 34' ' ' TYR . 48.3 t -49.97 -51.64 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.412 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 88.5 p -56.76 -45.91 81.75 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.493 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 93.6 m -68.31 -48.37 65.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.073 0.463 . . . . 0.0 110.873 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 78.0 mt -58.12 -45.78 86.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.515 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 73.2 t -69.41 -40.15 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -70.56 -29.33 65.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.901 ' O ' ' O ' ' B' ' 45' ' ' GLN . 38.5 m-20 -103.69 -150.39 0.42 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.831 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.901 ' O ' ' O ' ' B' ' 44' ' ' ASP . 46.2 tt0 34.13 130.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.942 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.51 87.74 1.18 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.625 0.726 . . . . 0.0 109.727 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -141.26 -27.45 0.69 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.344 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -179.21 141.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 111.091 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 15.9 p30 -59.9 -38.5 82.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.565 ' HB2' ' ND2' ' A' ' 49' ' ' ASN . . . -64.32 -39.97 94.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.426 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 38.0 t -61.42 -62.7 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.537 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.52 -31.99 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.34 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 51.4 tp -69.73 -42.2 74.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.34 0.591 . . . . 0.0 110.895 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.474 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 24.1 pttt -53.48 -37.29 62.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.217 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.64 ' HE ' HE22 ' B' ' 45' ' ' GLN . 92.3 mtt-85 -65.15 -30.46 71.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.348 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 20.8 mm -74.52 -46.78 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.33 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -64.47 -24.57 67.66 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.08 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 1.6 m-70 -65.63 -50.47 64.89 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.58 -20.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' B' ' 58' ' ' HIS . 81.6 m-20 -52.29 -45.45 65.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.381 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.401 ' CG ' ' N ' ' B' ' 62' ' ' ALA . 8.2 pt-20 -62.82 -41.13 99.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.529 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' ALA . . . . . 0.401 ' N ' ' CG ' ' B' ' 61' ' ' GLU . . . -71.96 -47.14 54.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.891 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -42.69 58.15 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.102 0.477 . . . . 0.0 109.84 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.78 -36.31 80.24 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.551 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -62.58 -40.86 98.22 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.35 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.9 t -59.75 -50.49 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.253 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -51.19 18.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.078 0.942 . . . . 0.0 111.749 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.52 -36.13 68.84 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.859 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.37 -9.27 67.94 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -108.01 -174.26 2.48 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.131 0.491 . . . . 0.0 110.428 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 30.4 t -166.98 36.1 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.42 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttp 46.97 28.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.877 0.37 . . . . 0.0 110.516 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 42.4 tp -57.71 -53.59 56.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.183 0.516 . . . . 0.0 110.679 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 55.18 77.22 0.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.661 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' B' ' 77' ' ' HIS . 1.0 OUTLIER -133.47 -12.79 2.69 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.535 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.461 ' O ' ' CE1' ' B' ' 78' ' ' HIS . 8.6 m80 68.54 -56.97 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.392 . . . . 0.0 110.498 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' B' ' 75' ' ' HIS . 76.9 m-70 54.32 88.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.307 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.461 ' CE1' ' O ' ' B' ' 76' ' ' HIS . 66.5 m80 -145.53 147.62 32.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.588 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 53.01 176.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.684 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.644 179.985 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.4 p -167.53 88.92 0.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.602 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -129.5 61.33 1.55 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.594 0.712 . . . . 0.0 111.097 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.91 ' H ' HD22 ' A' ' 4' ' ' LEU . 0.4 OUTLIER -83.87 74.62 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.579 179.07 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -63.58 -38.93 93.0 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.055 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p -82.88 127.21 33.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.249 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.587 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.1 t -67.33 -39.17 18.89 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.998 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -52.93 -21.67 16.25 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.896 1.731 . . . . 0.0 112.087 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.539 ' CD2' HD12 ' A' ' 4' ' ' LEU . 79.3 t80 -65.22 -43.86 90.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 110.635 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.454 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -64.01 -44.27 93.11 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.584 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.46 HD13 ' HD3' ' A' ' 65' ' ' LYS . 25.1 mt -66.77 -42.26 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.519 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -49.42 -26.06 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.251 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.13 -33.34 70.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.402 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ILE . 36.4 mt -72.15 -37.41 69.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.594 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.48 -38.98 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.136 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -65.55 -35.6 81.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.451 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.09 -51.42 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.654 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 19' ' ' GLU . 13.4 pt -74.45 -43.91 48.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.179 0.514 . . . . 0.0 111.025 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' HG13 ' A' ' 18' ' ' ILE . 82.2 tt0 -64.73 -52.15 58.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.543 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 35.7 mtt -104.75 -161.92 0.85 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.198 0.523 . . . . 0.0 110.022 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -150.78 47.91 0.86 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -57.14 -49.58 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.517 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.4 p -175.45 68.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.496 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -167.12 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.4 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -158.35 -166.25 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.121 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -80.91 -106.07 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.552 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.549 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.3 tt -64.57 -37.14 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 120.954 0.407 . . . . 0.0 110.568 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.85 9.79 0.08 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.588 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.07 -42.64 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -62.01 -47.05 86.52 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.166 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.742 ' C ' HD21 ' A' ' 31' ' ' ASN . 0.1 OUTLIER -51.9 -43.71 63.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.481 -178.773 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.8 m -71.11 -54.11 12.25 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.959 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.454 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 49.5 t80 -61.25 -43.79 98.3 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.746 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 39.2 t80 -58.56 -47.97 82.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.797 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.45 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 81.3 mtp180 -69.16 -27.67 65.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.376 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.7 t -66.46 -46.68 75.58 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.541 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.1 t -68.28 -45.87 81.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.513 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.5 t -51.87 -47.85 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.411 -179.394 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 t -57.32 -42.66 82.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.435 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.9 m -64.88 -45.28 86.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.941 0.4 . . . . 0.0 110.746 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.58 -47.17 85.17 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.614 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.5 t -71.68 -38.33 66.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.781 0.325 . . . . 0.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -71.76 -33.28 68.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.637 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 1.129 ' O ' ' O ' ' A' ' 45' ' ' GLN . 30.5 m-20 -74.59 173.83 9.88 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 1.129 ' O ' ' O ' ' A' ' 44' ' ' ASP . 15.3 pt20 5.64 -164.01 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 117.472 -1.251 . . . . 0.0 113.268 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.11 28.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.553 1.069 . . . . 0.0 109.769 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' N ' ' A' ' 48' ' ' LYS . 8.2 t -60.28 -42.57 95.72 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.334 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.594 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 82.5 tttt -162.82 135.41 5.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.429 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -62.22 -10.17 9.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.533 0.683 . . . . 0.0 111.521 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -73.88 -51.69 15.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.149 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 52' ' ' VAL . 12.0 m -59.26 -56.44 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.524 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.659 ' N ' HG23 ' A' ' 51' ' ' VAL . 4.3 m -51.81 -33.19 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-O 121.379 0.609 . . . . 0.0 110.391 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' HA ' HD12 ' A' ' 56' ' ' ILE . 5.0 tt -74.68 -29.66 61.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.549 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.2 pttm -51.99 -37.89 54.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.619 0.724 . . . . 0.0 110.315 -179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -75.71 -37.2 59.65 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.308 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' A' ' 53' ' ' LEU . 67.7 mt -58.66 -50.61 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.14 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -58.62 -37.05 75.04 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 41.7 m170 -74.55 -39.75 62.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.368 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -53.4 -34.74 58.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.346 -178.583 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -50.26 -26.19 4.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.551 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.99 -37.85 83.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.781 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.97 -49.51 28.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -39.46 34.21 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.938 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -64.74 -41.04 96.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.444 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HD3' HD13 ' A' ' 11' ' ' ILE . 51.8 mtpt -64.26 -33.11 75.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.307 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.04 -42.78 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-O 121.695 0.759 . . . . 0.0 110.344 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HD2' HD11 ' A' ' 27' ' ' ILE . 18.4 mmmt -66.68 -46.86 74.26 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.163 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -78.05 -14.66 59.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.339 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.84 -40.22 5.32 Favored Glycine 0 N--CA 1.47 0.932 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.525 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.2 pp20? -71.15 -31.05 67.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 110.422 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 p -140.36 112.52 7.74 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.401 0.619 . . . . 0.0 110.762 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.1 -113.74 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.271 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.1 mt -106.32 45.18 0.99 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.375 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -89.34 -26.33 21.15 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.572 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.9 m170 53.91 79.19 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.504 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -73.3 -7.44 51.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.555 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.476 ' CG ' ' N ' ' A' ' 78' ' ' HIS . 57.4 t-80 -156.51 166.05 34.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.573 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.476 ' N ' ' CG ' ' A' ' 77' ' ' HIS . 78.8 m80 -72.22 151.55 42.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 80' ' ' HIS . 58.8 t-80 -162.78 133.52 4.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.53 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' A' ' 79' ' ' HIS . 80.1 m80 . . . . . 0 C--O 1.221 -0.401 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.46 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.493 ' SD ' ' N ' ' B' ' 1' ' ' MET . 2.3 mpt? . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' SER . . . . . 0.423 ' O ' ' O ' ' B' ' 1' ' ' MET . 8.2 m 59.38 142.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.716 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -79.02 35.31 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.956 0.408 . . . . 0.0 110.523 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.404 ' H ' ' C ' ' B' ' 2' ' ' SER . 34.2 mt 49.39 19.08 0.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.633 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -69.8 -36.46 75.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.373 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -81.49 135.83 35.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.096 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.7 t -71.02 -39.96 9.03 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.892 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 64.6 Cg_exo -52.42 -15.77 4.34 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.987 1.792 . . . . 0.0 112.034 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -67.57 -51.57 49.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.944 0.402 . . . . 0.0 110.378 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.408 ' CD2' HD21 ' B' ' 59' ' ' LEU . 0.2 OUTLIER -61.91 -40.82 96.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.311 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -63.12 -42.8 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.509 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -49.13 -23.78 1.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.586 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.417 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.641 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.1 mp -70.15 -39.72 75.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.533 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -57.14 -31.58 65.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.046 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.97 -35.39 80.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.52 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -62.58 -52.05 64.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.879 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.7 -43.87 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.408 0.623 . . . . 0.0 110.806 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -63.91 -23.8 67.49 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.473 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 36.6 mtt -138.6 -146.89 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.109 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -170.08 39.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.223 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' GLN . . . . . 0.404 ' O ' ' OG ' ' B' ' 23' ' ' SER . 1.1 tm0? -50.99 -40.2 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.967 0.413 . . . . 0.0 110.756 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 5.0 m -177.46 64.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.185 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -164.66 -135.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.312 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -157.23 -161.31 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.26 0.552 . . . . 0.0 110.318 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.422 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 62.0 tttm -86.49 -103.59 0.07 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.352 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.517 ' C ' ' H ' ' B' ' 29' ' ' ALA . 44.8 mm -64.6 -40.99 90.97 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -61.16 3.39 0.1 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.789 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.517 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -74.08 -44.87 52.45 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.55 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.576 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.83 -47.23 84.29 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.25 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.576 ' N ' ' SD ' ' B' ' 30' ' ' MET . 2.0 t30 -54.97 -53.36 56.66 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.714 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -62.49 -53.29 57.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.833 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.61 ' CE2' HD11 ' B' ' 14' ' ' LEU . 77.7 t80 -60.38 -49.08 78.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.495 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.437 ' CB ' ' O ' ' B' ' 30' ' ' MET . 35.3 t80 -57.86 -54.56 45.48 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.794 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -61.63 -32.73 72.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 121.155 0.503 . . . . 0.0 110.429 -179.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -68.75 -44.14 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.771 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 38.5 t -66.59 -63.95 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.646 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.578 HG23 ' N ' ' B' ' 39' ' ' SER . 20.2 m -48.5 -45.87 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.518 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.578 ' N ' HG23 ' B' ' 38' ' ' VAL . 46.1 t -60.15 -41.08 91.98 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.281 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -69.0 -49.21 59.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.968 0.413 . . . . 0.0 110.708 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.66 -40.4 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.514 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.672 ' O ' HG12 ' B' ' 42' ' ' VAL . 60.7 t -85.1 19.76 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.076 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -162.12 21.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -161.98 14.14 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -172.6 55.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.545 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 mt -87.67 48.63 1.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.409 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -72.28 -27.17 62.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.31 0.576 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -172.32 133.74 0.67 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.868 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' B' ' 53' ' ' LEU . 58.3 m-20 -52.38 -42.87 64.35 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.465 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.59 86.99 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.939 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -51.97 -44.23 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.434 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.46 -39.75 23.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.185 0.516 . . . . 0.0 110.642 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' B' ' 49' ' ' ASN . 0.2 OUTLIER -55.44 -58.62 7.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.912 -178.4 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -55.71 -37.96 69.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.365 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -64.2 -41.34 97.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.481 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.425 ' O ' ' N ' ' B' ' 59' ' ' LEU . 94.3 mt -65.74 -49.0 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.264 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -49.41 -30.85 8.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.237 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -71.42 -29.24 64.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' B' ' 56' ' ' ILE . 0.4 OUTLIER -77.46 -26.32 51.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.125 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -61.94 -54.6 39.54 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.455 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -62.35 -26.45 68.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.703 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -52.09 17.62 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 120.826 0.346 . . . . 0.0 110.851 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.433 ' CD1' ' C ' ' B' ' 63' ' ' TYR . 0.0 OUTLIER -53.35 -44.68 68.7 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.017 -179.661 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -66.58 -31.17 71.7 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.159 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -63.61 -31.27 72.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.531 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -63.75 -55.44 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.3 0.572 . . . . 0.0 110.656 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -69.8 -46.37 65.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.347 1.07 . . . . 0.0 111.881 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -44.27 -35.93 2.52 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.068 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.49 -55.76 4.15 Favored Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -47.05 -84.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.642 0.258 . . . . 0.0 110.844 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 25.2 t 51.27 -151.29 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.081 0.467 . . . . 0.0 110.442 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -56.63 -69.74 0.14 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.648 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.428 HD23 ' H ' ' B' ' 75' ' ' HIS . 0.6 OUTLIER -174.37 129.1 0.35 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.961 0.41 . . . . 0.0 110.3 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -143.56 24.09 1.75 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.464 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.428 ' H ' HD23 ' B' ' 73' ' ' LEU . 81.8 t60 -89.79 115.87 27.46 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.039 0.447 . . . . 0.0 110.375 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -72.78 131.81 42.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.503 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -76.35 148.31 37.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.354 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -137.21 121.54 18.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.609 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -64.31 -47.01 81.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.428 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 p80 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.522 -179.908 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.523 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.5 t 55.33 172.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -68.99 178.78 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.315 0.579 . . . . 0.0 110.069 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' A' ' 5' ' ' PHE . 5.4 mp -74.3 -93.89 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.678 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.492 ' O ' ' CB ' ' A' ' 6' ' ' SER . 87.2 t80 36.78 74.33 0.08 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.497 0.665 . . . . 0.0 110.9 -179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 5' ' ' PHE . 3.2 t 151.24 72.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.063 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.474 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -34.22 -53.03 0.93 Allowed Pre-proline 0 N--CA 1.482 1.171 0 CA-C-N 118.225 0.466 . . . . 0.0 111.146 178.276 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 11.3 Cg_endo -51.29 -21.17 9.31 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 120.407 0.738 . . . . 0.0 112.671 178.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 6' ' ' SER . 7.3 t80 -62.2 -42.96 99.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.341 0.591 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.1 -52.49 6.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.879 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.2 mt -53.66 -35.85 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.601 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -49.3 -31.07 8.37 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.22 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.476 ' OD1' ' NE2' ' A' ' 17' ' ' HIS . 53.4 t-20 -72.37 -45.34 60.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.211 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 ' CD1' ' A' ' 33' ' ' TYR . 56.5 mt -61.45 -42.5 98.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.613 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.31 -38.84 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -69.04 -33.92 74.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.685 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.476 ' NE2' ' OD1' ' A' ' 13' ' ' ASN . 8.8 m-70 -63.62 -51.74 63.92 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.715 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.5 pt -70.17 -42.54 79.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.119 0.485 . . . . 0.0 110.938 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -57.63 -52.2 66.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.206 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 63.6 mtm -114.29 -125.53 0.28 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.432 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -170.07 61.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.396 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -73.19 51.74 0.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.968 0.889 . . . . 0.0 110.91 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 23' ' ' SER . 3.4 p 77.42 46.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.257 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -147.18 -142.88 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.627 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -153.54 -168.28 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.234 0.54 . . . . 0.0 110.657 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.33 -100.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.176 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.647 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.0 tp -63.53 -42.45 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.467 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.5 m-70 -63.82 19.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.873 0.368 . . . . 0.0 110.99 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.647 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -79.73 -46.7 16.57 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.268 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.557 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.98 -50.64 65.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.252 -179.2 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.478 ' N ' ' SD ' ' A' ' 30' ' ' MET . 82.5 m-20 -51.41 -38.55 54.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.453 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 t -77.2 -54.26 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.615 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.552 ' CD1' HD21 ' A' ' 14' ' ' LEU . 58.4 t80 -63.95 -47.69 79.45 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.18 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.551 ' N ' ' O ' ' A' ' 30' ' ' MET . 57.7 t80 -55.56 -51.77 65.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.751 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.6 ttt85 -63.35 -34.73 78.35 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -63.93 -42.52 97.33 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.364 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.98 -56.83 9.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.376 -0.529 . . . . 0.0 110.171 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.7 t -50.01 -45.35 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.417 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.1 m -68.69 -18.74 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.668 0.27 . . . . 0.0 110.416 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.512 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.4 m -88.63 -54.31 4.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.066 0.46 . . . . 0.0 110.961 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.5 mt -61.5 -39.5 91.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.445 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 p -69.31 -25.53 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.4 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -98.75 -22.13 16.03 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.191 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 40' ' ' THR . 14.3 m-20 -91.04 -34.77 14.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.948 0.404 . . . . 0.0 110.518 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -106.98 161.6 14.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.374 0.607 . . . . 0.0 110.211 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -168.27 22.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.367 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 49.9 m -61.5 -42.99 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.467 0.651 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 8.3 ttmt -173.86 141.51 0.81 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.703 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -48.78 -38.39 21.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.38 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.498 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -69.03 -50.16 51.1 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.351 -0.539 . . . . 0.0 110.765 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 37.5 t -52.41 -43.57 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.499 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.4 m -78.69 -37.92 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.242 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -62.28 -46.29 89.42 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.098 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 17.9 ptmt -54.85 -40.93 70.15 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.03 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.416 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 93.1 mtt180 -63.95 -39.54 94.38 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.824 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.9 mt -69.06 -48.66 68.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.6 -34.4 71.08 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.411 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -76.56 -43.14 40.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.871 0.367 . . . . 0.0 110.358 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.4 tp -48.76 -22.63 0.84 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.447 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 10.8 p-10 -58.6 -26.66 63.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.021 0.438 . . . . 0.0 110.416 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 10.4 pt-20 -60.85 -38.63 86.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.407 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.28 -55.06 10.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.401 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.665 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -51.23 -46.07 62.17 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.264 0.554 . . . . 0.0 110.211 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -61.66 -33.09 73.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.128 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.6 tptm -62.8 -39.61 94.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.85 -48.72 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.339 0.59 . . . . 0.0 110.132 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -42.71 93.54 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 122.016 0.912 . . . . 0.0 111.523 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -60.87 -34.85 75.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.942 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.2 -25.57 28.41 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 110.864 -0.895 . . . . 0.0 110.864 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -104.89 -160.71 0.77 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.131 0.491 . . . . 0.0 110.253 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 t 53.54 74.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.438 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -73.29 -28.63 62.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.482 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.62 ' O ' ' N ' ' A' ' 75' ' ' HIS . 7.7 tp -44.63 -63.66 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.433 0.635 . . . . 0.0 110.857 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 55.92 -71.1 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.801 0.81 . . . . 0.0 110.834 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.62 ' N ' ' O ' ' A' ' 73' ' ' LEU . 30.2 p-80 -167.1 160.76 14.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.708 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -64.52 138.41 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.406 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -61.68 138.48 58.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.434 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -73.1 153.87 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.457 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -144.6 146.94 32.57 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.58 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.495 ' N ' ' ND1' ' A' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.398 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 79.2 p -74.57 157.4 35.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -65.32 157.19 29.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.278 0.561 . . . . 0.0 110.54 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 40.8 mt -64.2 -41.5 97.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.736 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.467 ' O ' ' CB ' ' B' ' 6' ' ' SER . 83.3 t80 -48.57 105.49 0.08 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.837 0.827 . . . . 0.0 110.252 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' B' ' 5' ' ' PHE . 1.0 OUTLIER 161.25 97.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.472 179.601 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.496 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 18.7 t -46.22 -43.27 32.7 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.369 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 23.8 Cg_exo -66.16 -20.75 56.19 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 120.401 0.734 . . . . 0.0 111.805 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.52 -57.43 3.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.341 0.591 . . . . 0.0 110.942 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -43.91 -47.45 8.4 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.622 -178.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 70.4 mt -66.46 -48.19 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.38 0.61 . . . . 0.0 111.234 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.24 -27.82 0.7 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.716 -178.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' B' ' 17' ' ' HIS . 18.9 m120 -75.13 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.307 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 34.8 mt -61.63 -43.25 99.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.225 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -59.06 -44.03 91.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 20' ' ' MET . 56.5 tt0 -67.57 -29.5 68.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.89 0.376 . . . . 0.0 110.245 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' B' ' 13' ' ' ASN . 47.8 m170 -67.95 -53.69 24.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -72.97 -43.48 58.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.132 0.492 . . . . 0.0 110.707 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -69.56 -48.36 60.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.353 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.437 ' CB ' ' O ' ' B' ' 16' ' ' GLN . 3.9 tpp -99.94 -163.7 1.05 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.357 0.599 . . . . 0.0 110.19 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -155.78 41.55 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.436 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -58.88 -49.2 78.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.469 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -175.45 69.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -163.8 -148.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.083 0.468 . . . . 0.0 110.201 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -142.76 -164.46 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.363 0.601 . . . . 0.0 110.43 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -88.81 -104.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.441 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.536 HD13 ' OE1' ' B' ' 70' ' ' GLU . 7.0 tp -61.05 -40.67 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' HIS . . . . . 0.452 ' N ' HG23 ' B' ' 27' ' ' ILE . 77.5 m80 -60.02 -14.5 16.59 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.261 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.97 -45.08 51.21 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.525 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 14.0 ptt? -63.4 -52.14 62.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.316 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.525 ' N ' ' CG ' ' B' ' 30' ' ' MET . 97.8 m-20 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.775 -178.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.6 t -63.11 -45.33 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.57 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -75.25 -46.75 31.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.804 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.434 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.2 t80 -49.02 -51.3 31.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.766 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.665 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 67.5 ttt-85 -66.41 -28.94 69.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 5.6 t -62.27 -44.23 97.01 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' B' ' 41' ' ' LEU . 66.4 t -70.79 -58.92 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.862 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -49.43 -49.26 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.763 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 59.7 p -49.04 -61.26 2.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.383 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -73.0 -44.66 60.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 122.443 1.116 . . . . 0.0 111.534 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' B' ' 37' ' ' VAL . 53.6 tp -53.53 -28.51 31.77 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.512 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.686 ' O ' HG12 ' B' ' 42' ' ' VAL . 96.1 t -96.48 21.9 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.16 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -138.05 -2.29 1.89 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.457 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -101.83 -38.62 7.76 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 110.358 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -110.29 174.13 6.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.522 0.677 . . . . 0.0 110.018 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -178.61 26.3 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.208 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -71.7 -34.18 69.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.357 0.598 . . . . 0.0 110.725 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 tptm -169.35 129.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.621 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-20 -49.43 -32.38 11.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.232 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.52 -50.77 34.2 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.318 0.58 . . . . 0.0 110.702 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.9 t -49.49 -43.67 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.447 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -75.98 -36.63 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 120.159 -0.616 . . . . 0.0 111.028 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.51 -35.61 81.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.648 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 65.2 mttm -54.6 -44.63 73.23 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.204 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -69.77 -40.78 75.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 80.1 mt -63.67 -54.65 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.801 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.15 -34.13 69.94 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 5.1 m-70 -76.61 -42.47 42.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.478 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 57.1 tp -47.07 -22.15 0.32 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.583 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 21.7 p-10 -58.94 -28.23 66.06 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.372 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 12.5 pt-20 -56.86 -40.48 76.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.343 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -51.44 32.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.571 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -39.21 15.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 121.035 0.445 . . . . 0.0 109.926 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.42 -34.17 77.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.561 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 tptt -57.32 -42.95 82.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.455 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.41 -47.3 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 122.286 1.041 . . . . 0.0 110.718 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.37 92.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.893 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 -67.02 -16.04 64.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.065 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.52 -63.98 1.12 Allowed Glycine 0 N--CA 1.463 0.441 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.638 ' CG ' ' H ' ' B' ' 71' ' ' SER . 0.0 OUTLIER -50.44 -94.49 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 110.626 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.638 ' H ' ' CG ' ' B' ' 70' ' ' GLU . 96.0 p 47.61 -160.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.1 0.476 . . . . 0.0 110.515 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -94.08 -37.08 11.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.567 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 15.9 mt -77.94 130.2 36.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.481 0.657 . . . . 0.0 110.126 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -137.17 66.13 1.47 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.338 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' B' ' 77' ' ' HIS . 53.4 t60 -76.64 128.91 35.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.246 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 98.3 m-70 -157.49 -56.02 0.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.492 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' B' ' 75' ' ' HIS . 1.5 m80 58.6 140.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.609 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -72.6 154.04 40.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.859 0.362 . . . . 0.0 110.375 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -63.63 138.84 58.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.422 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 C--O 1.219 -0.506 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.706 -179.986 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -167.48 71.78 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 0.0 110.62 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -90.0 82.54 6.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.336 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.6 mt -66.28 -24.04 66.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.335 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -59.07 -45.33 91.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.247 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.3 p -76.36 126.67 31.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.514 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.5 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 78.1 t -59.47 -44.84 98.58 Favored Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-O 119.036 -0.506 . . . . 0.0 109.858 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -44.7 -31.72 5.25 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.241 1.294 . . . . 0.0 112.317 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.55 -43.05 89.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.923 0.392 . . . . 0.0 110.237 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -66.1 -45.54 80.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.458 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.34 -50.44 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.92 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -47.29 -39.94 15.73 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.676 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -51.84 -30.49 23.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.315 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.58 -41.22 63.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.568 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -54.78 -34.13 62.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 120.92 0.391 . . . . 0.0 110.177 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -64.34 -27.44 69.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.333 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.422 ' O ' ' CA ' ' A' ' 21' ' ' ASN . 2.0 m-70 -71.71 -52.86 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.6 pt -73.98 -38.19 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.446 0.641 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -62.58 -44.67 95.73 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.691 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.443 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 28.8 ttp -114.96 -65.06 1.23 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.294 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.443 ' CB ' ' O ' ' A' ' 20' ' ' MET . 5.6 t30 81.48 45.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -55.18 -37.41 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.166 0.507 . . . . 0.0 110.556 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.1 m -158.12 63.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.643 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -159.66 -130.93 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.981 0.419 . . . . 0.0 110.491 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 65.3 m-20 -159.39 167.66 28.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.197 0.523 . . . . 0.0 110.429 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 87.5 tttt -69.9 -99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.454 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.565 ' C ' ' H ' ' A' ' 29' ' ' ALA . 10.7 tp -61.14 -43.15 95.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.015 0.436 . . . . 0.0 110.637 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.503 ' N ' HG23 ' A' ' 27' ' ' ILE . 94.8 m-70 -67.72 17.91 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.642 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -58.97 -51.93 67.96 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' HG21 ' A' ' 66' ' ' VAL . 66.9 mmm -61.68 -44.55 96.74 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.106 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -46.55 -33.69 4.3 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.562 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 m -89.15 -57.11 3.01 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.913 0.387 . . . . 0.0 110.736 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CE2' ' A' ' 10' ' ' PHE . 38.6 t80 -61.37 -53.06 61.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 28.0 t80 -49.01 -49.55 40.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.234 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -66.5 -28.56 68.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.301 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.5 t -63.4 -46.18 87.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.359 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.458 ' O ' ' N ' ' A' ' 41' ' ' LEU . 35.3 t -71.0 -56.34 10.95 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.5 t -51.36 -47.67 34.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.454 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 p -53.82 -60.28 3.52 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.085 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.1 m -69.49 -44.58 70.81 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.919 0.866 . . . . 0.0 111.045 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' A' ' 37' ' ' VAL . 41.8 tp -56.26 -27.77 56.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.598 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 98.6 t -101.87 -33.64 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.205 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -80.16 -0.29 35.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.339 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 43.5 t0 -145.46 165.16 29.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.37 0.605 . . . . 0.0 110.252 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.3 tt0 72.42 -78.28 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.606 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt 42.09 41.15 1.9 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.403 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 11.4 t -73.4 -34.61 65.6 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.397 0.618 . . . . 0.0 110.79 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -167.49 133.68 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.784 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 51.9 m-20 -49.72 -47.07 50.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.664 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.61 83.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.774 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.0 t -52.96 -43.84 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.547 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.451 ' O ' HG12 ' A' ' 56' ' ' ILE . 28.8 m -81.1 -46.33 20.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.161 0.505 . . . . 0.0 110.556 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.467 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -57.15 -55.94 28.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.808 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 17.4 ptmt -50.99 -40.02 57.04 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.236 0.541 . . . . 0.0 110.411 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.439 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 40.0 ttm180 -65.08 -39.18 92.84 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.147 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 52' ' ' VAL . 34.3 mm -61.36 -52.95 55.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.247 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -52.52 -40.97 63.03 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.465 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 2.8 t-80 -66.97 -46.16 75.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.11 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 29.3 tp -53.0 -23.65 7.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.917 0.389 . . . . 0.0 110.598 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -55.64 -49.26 73.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.434 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 6.2 pt-20 -50.74 -28.59 9.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.684 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -68.56 -62.22 1.49 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.34 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.573 ' CE2' ' ND2' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -52.47 -38.89 60.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.038 0.447 . . . . 0.0 110.25 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.573 ' ND2' ' CE2' ' A' ' 63' ' ' TYR . 20.9 m120 -65.32 -27.64 68.74 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.165 -179.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -75.88 -39.74 55.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.475 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.576 HG21 ' SD ' ' A' ' 30' ' ' MET . 99.1 t -63.03 -52.05 64.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.587 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -63.26 -44.96 93.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.801 0.81 . . . . 0.0 111.072 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 64' ' ' ASN . 12.1 mmm180 -55.34 -31.38 61.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.981 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.96 -22.31 61.53 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -85.94 -168.04 2.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.391 . . . . 0.0 110.546 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.471 ' O ' ' C ' ' A' ' 72' ' ' LYS . 68.3 m -91.21 54.3 2.55 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.176 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.471 ' C ' ' O ' ' A' ' 71' ' ' SER . 47.7 mtpt 29.42 -125.23 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.1 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 75' ' ' HIS . 24.6 mt -95.54 17.24 15.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.159 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 52.62 11.52 0.19 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.087 0.47 . . . . 0.0 110.557 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.428 ' H ' ' C ' ' A' ' 73' ' ' LEU . 98.5 m-70 52.0 177.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.557 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -155.82 9.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.492 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 84.4 t60 51.11 98.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 52.3 p-80 -63.92 179.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.568 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.423 ' O ' ' CG ' ' A' ' 79' ' ' HIS . 6.3 p80 -161.44 84.87 0.64 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.415 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.734 179.826 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -66.54 134.98 53.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.439 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -84.18 137.99 33.22 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.272 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.86 -35.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.527 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -60.66 -44.38 96.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.237 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p -66.51 125.87 27.09 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.405 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.549 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -57.32 -42.61 96.9 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.967 179.107 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.9 Cg_exo -50.16 -31.16 27.74 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 121.737 1.624 . . . . 0.0 112.097 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -59.98 -43.87 94.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 110.339 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.455 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -63.79 -46.43 85.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.215 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.3 mt -61.11 -47.04 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-O 121.052 0.453 . . . . 0.0 110.587 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -48.43 -35.0 11.91 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 29.7 m-20 -58.39 -34.31 70.59 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.672 ' N ' HD12 ' B' ' 14' ' ' LEU . 6.6 mp -72.44 -37.23 68.62 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.246 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.82 -38.32 87.7 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.329 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -54.26 -24.93 20.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.556 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.425 ' O ' ' CA ' ' B' ' 21' ' ' ASN . 28.3 m170 -76.38 -54.62 6.49 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -70.84 -38.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.483 0.659 . . . . 0.0 110.625 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -63.72 -43.0 97.83 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 48.9 mtt -115.56 -65.16 1.22 Allowed 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.066 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.444 ' CB ' ' O ' ' B' ' 20' ' ' MET . 24.3 t30 82.9 46.78 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.831 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.7 -40.98 85.22 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.411 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -158.57 69.81 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.576 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -165.17 -125.32 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.076 0.465 . . . . 0.0 110.338 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -158.17 -175.92 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.33 0.586 . . . . 0.0 110.048 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -86.4 -98.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.444 ' C ' ' H ' ' B' ' 29' ' ' ALA . 4.3 mm -61.71 -43.16 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.436 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -62.14 -0.58 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.74 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.444 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.29 -49.86 74.73 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.114 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -68.67 -40.51 80.09 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.283 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' B' ' 30' ' ' MET . 40.7 t30 -55.54 -50.62 69.54 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.668 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.2 t -67.01 -51.45 54.75 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.696 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.604 ' CE1' HD11 ' B' ' 14' ' ' LEU . 54.1 t80 -61.43 -50.0 74.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.478 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' B' ' 30' ' ' MET . 39.4 t80 -55.98 -48.48 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.104 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -64.87 -34.36 78.19 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.857 0.361 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -67.75 -39.07 84.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.646 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.4 HG21 ' CE1' ' B' ' 33' ' ' TYR . 43.0 t -68.97 -63.45 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.401 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.522 HG23 ' N ' ' B' ' 39' ' ' SER . 23.7 m -50.55 -42.31 21.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.369 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.522 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.2 p -62.05 -46.23 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.419 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.1 m -63.65 -44.28 94.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.399 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.504 ' O ' ' O ' ' B' ' 44' ' ' ASP . 90.4 mt -70.37 -50.67 36.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.705 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 62.8 t -60.91 -19.19 19.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.082 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -103.62 6.69 37.3 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.855 0.36 . . . . 0.0 110.854 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.504 ' O ' ' O ' ' B' ' 41' ' ' LEU . 39.7 t0 -148.35 170.12 18.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.606 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.459 HE22 HH12 ' B' ' 55' ' ' ARG . 5.4 pt20 39.88 48.28 2.01 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.352 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.37 46.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.353 -179.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.403 HG23 ' N ' ' B' ' 48' ' ' LYS . 3.6 t -61.04 -41.16 96.05 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.204 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.403 ' N ' HG23 ' B' ' 47' ' ' THR . 39.7 tptt -167.32 134.43 2.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.754 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 53.6 m-20 -50.24 -37.51 36.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.539 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.98 -51.27 68.76 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.49 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 36.7 t -50.61 -38.65 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.988 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 5.2 t -80.76 -43.06 20.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.597 0.713 . . . . 0.0 111.008 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.93 -52.75 62.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.141 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.48 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 49.9 pttt -51.34 -42.39 61.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.48 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 78.3 mtp180 -65.71 -45.35 83.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.336 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.78 -54.83 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.739 -0.385 . . . . 0.0 110.362 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 93.7 mt-30 -53.2 -40.21 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.313 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 57.0 m170 -75.21 -38.27 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.275 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 52.8 tp -51.75 -32.28 30.03 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.63 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.95 -29.03 11.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.482 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -56.69 -35.57 68.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.6 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -60.83 2.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.486 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -43.43 22.22 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.961 0.41 . . . . 0.0 110.158 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -62.05 -39.66 93.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.293 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 tptm -66.74 -36.63 82.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.441 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.4 -51.07 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.232 0.539 . . . . 0.0 110.355 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -66.33 -48.39 70.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.267 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -61.08 -21.64 63.87 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.219 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.6 -27.11 48.52 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.482 ' O ' ' N ' ' B' ' 72' ' ' LYS . 36.8 mm-40 -70.66 -115.7 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 2.8 t 66.26 -64.43 0.22 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.677 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' B' ' 70' ' ' GLU . 99.7 mttt 53.02 33.97 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.374 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.452 HD13 ' O ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -62.25 -56.9 13.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.97 -179.13 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -51.13 -96.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.515 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -159.11 152.21 22.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.198 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.623 ' CG ' ' H ' ' B' ' 77' ' ' HIS . 78.9 t60 -157.24 178.67 10.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.192 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.623 ' H ' ' CG ' ' B' ' 76' ' ' HIS . 33.4 p-80 -148.63 165.71 30.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.461 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -137.15 136.73 38.5 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 77.1 m80 47.13 63.19 2.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.702 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.0 t60 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.379 -179.81 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m -72.32 144.32 48.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.37 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -74.35 125.58 28.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.15 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 50.7 mt 45.26 -152.37 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.516 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 32.8 t80 68.22 -50.02 0.55 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.117 0.484 . . . . 0.0 110.573 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.16 102.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.208 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.492 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.0 t -47.56 -42.64 44.77 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 118.854 -0.593 . . . . 0.0 110.245 179.153 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 37.8 Cg_exo -58.62 -22.89 62.71 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 120.754 0.97 . . . . 0.0 111.86 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.77 -48.35 77.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.912 0.387 . . . . 0.0 110.547 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.4 m-85 -48.83 -45.3 40.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.297 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 14' ' ' LEU . 45.9 mt -70.21 -50.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.695 0.76 . . . . 0.0 110.833 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -48.41 -24.13 1.15 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.412 -178.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -72.3 -36.47 68.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.45 . . . . 0.0 110.179 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 11' ' ' ILE . 17.0 mt -70.52 -48.12 57.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.387 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -59.02 -27.8 65.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.287 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -62.53 -27.52 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.18 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.436 ' CE1' ' CA ' ' A' ' 25' ' ' ASP . 58.5 t-80 -81.86 -60.69 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.488 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.417 ' H ' HG23 ' A' ' 18' ' ' ILE . 2.4 pt -50.9 -39.06 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.836 0.827 . . . . 0.0 110.259 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -72.21 -32.15 66.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.458 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.54 -121.77 0.15 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -174.61 72.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.357 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -77.21 -54.98 5.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.13 0.49 . . . . 0.0 110.198 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 m 170.61 78.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.367 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -170.68 -131.54 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.288 0.565 . . . . 0.0 110.219 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.436 ' CA ' ' CE1' ' A' ' 17' ' ' HIS . 71.5 m-20 -152.23 176.53 11.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.3 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -72.89 -102.47 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.506 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.406 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.9 mm -64.29 -41.49 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -55.43 -9.23 0.44 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.204 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.406 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -51.88 -42.64 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.513 ' CG ' ' N ' ' A' ' 31' ' ' ASN . 11.6 ptt? -66.05 -54.62 23.56 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.513 ' N ' ' CG ' ' A' ' 30' ' ' MET . 61.6 t-20 -57.3 -55.01 40.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.649 -178.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -56.39 -51.43 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.642 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 58.5 t80 -63.02 -47.16 84.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 38' ' ' VAL . 22.1 t80 -53.4 -43.88 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.864 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -74.73 -28.32 60.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.827 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 p -64.51 -44.91 89.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.43 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.1 t -72.01 -54.18 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 34' ' ' TYR . 94.3 t -48.53 -47.01 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 -179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.7 t -56.65 -46.94 80.77 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.277 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.4 m -64.57 -45.4 87.2 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.41 0.624 . . . . 0.0 111.272 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.06 -37.83 88.83 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.726 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 42' ' ' VAL . 48.5 t -92.9 25.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.695 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -147.49 -0.89 0.64 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.45 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 46' ' ' LEU . 73.4 m-20 -145.41 170.83 15.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.309 0.576 . . . . 0.0 110.288 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 62.35 -71.56 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.428 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' ASP . 15.8 mt 44.53 70.45 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.277 0.561 . . . . 0.0 110.604 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -109.53 -31.12 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.439 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -171.6 129.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.65 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.5 m-20 -49.15 -38.8 26.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.513 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.8 76.92 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.847 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.6 t -54.48 -55.14 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.418 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.415 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.7 m -64.64 -40.71 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.257 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.415 ' N ' HG23 ' A' ' 52' ' ' VAL . 66.0 tp -60.96 -43.1 99.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.359 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 51.1 mtpt -56.66 -41.19 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.08 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -64.41 -39.9 94.75 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 89.9 mt -69.09 -51.92 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -55.42 -38.44 68.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.143 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 5.5 m-70 -73.36 -22.62 60.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -63.02 -34.24 77.14 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 41.0 p-10 -47.2 -25.48 0.93 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.013 0.435 . . . . 0.0 110.381 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.451 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 12.6 pt-20 -58.76 -40.1 82.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.331 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.93 -58.05 4.67 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.395 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -46.19 -43.51 15.31 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.139 0.495 . . . . 0.0 110.076 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.98 -44.69 88.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.696 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -62.64 -39.31 93.46 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.915 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.17 -47.19 91.04 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.67 0 CA-C-O 121.855 0.836 . . . . 0.0 109.929 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -65.13 -43.74 90.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.353 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -74.33 -5.04 39.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.096 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.603 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -106.12 -77.57 1.11 Allowed Glycine 0 N--CA 1.46 0.291 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.603 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 pt-20 6.28 -101.65 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.529 -0.335 . . . . 0.0 111.637 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.407 ' H ' ' CG ' ' A' ' 70' ' ' GLU . 67.2 m -158.56 159.25 35.31 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.269 0.557 . . . . 0.0 109.745 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.526 ' C ' ' H ' ' A' ' 74' ' ' GLU . 27.1 ttmt -90.36 156.59 18.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.03 -179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 tp 68.1 -10.9 0.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.213 0.53 . . . . 0.0 110.797 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.526 ' H ' ' C ' ' A' ' 72' ' ' LYS . 86.7 mt-10 -100.91 61.61 0.97 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.37 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -110.21 152.91 25.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -76.1 134.03 40.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.501 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -70.15 137.12 50.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.439 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.529 ' CG ' ' H ' ' A' ' 79' ' ' HIS . 56.0 t-80 -151.45 174.01 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.499 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.529 ' H ' ' CG ' ' A' ' 78' ' ' HIS . 97.5 m-70 -58.53 -39.57 80.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.524 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 31.1 p80 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.438 -179.992 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.2 mmm . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 93.7 p -64.88 149.72 49.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.536 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -91.19 93.94 9.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.34 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.52 ' N ' HD12 ' B' ' 4' ' ' LEU . 9.8 mp -71.0 -23.54 62.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.048 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.45 -43.08 88.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.184 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -62.86 123.04 17.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.316 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.539 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.76 -42.33 87.01 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.601 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 51.5 Cg_exo -54.07 -23.64 29.57 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 121.476 1.45 . . . . 0.0 112.094 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -67.01 -39.41 87.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.628 0.252 . . . . 0.0 110.573 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.407 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.37 -40.23 90.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.102 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ILE . . . . . 0.45 ' O ' ' N ' ' B' ' 14' ' ' LEU . 96.8 mt -68.13 -45.66 82.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.512 0.672 . . . . 0.0 110.796 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -47.76 -25.16 1.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.327 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -73.94 -35.37 64.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.053 0.454 . . . . 0.0 110.166 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 11' ' ' ILE . 29.4 mt -70.89 -39.61 72.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.658 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -57.57 -35.55 70.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.099 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -71.33 -28.91 64.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.632 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 52.0 m170 -67.38 -49.88 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.66 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.86 -43.5 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -59.7 -51.55 69.32 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.373 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 52.1 mtm -118.73 -145.34 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.946 0.403 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -157.49 57.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.344 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 65.2 tp60 -61.11 -45.19 95.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.236 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 t 177.57 69.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -169.73 -133.24 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.402 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -151.01 -166.81 2.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.456 0.646 . . . . 0.0 110.269 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -82.23 -109.46 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.423 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.598 HD11 ' HD2' ' B' ' 67' ' ' LYS . 20.4 tt -65.36 -37.46 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 121.091 0.472 . . . . 0.0 110.552 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -57.37 -22.16 40.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.467 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.98 -33.76 2.16 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.611 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -66.18 -52.75 45.16 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.015 178.599 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.611 ' N ' ' SD ' ' B' ' 30' ' ' MET . 3.0 t-20 -55.35 -50.97 68.26 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.724 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.4 t -61.29 -48.34 81.85 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.407 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 60.0 t80 -70.25 -20.74 63.05 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 40.2 t80 -73.09 -53.1 11.91 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.297 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -68.83 -23.0 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.495 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -70.0 -47.61 61.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.581 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 66.8 t -70.13 -57.9 6.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.106 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.428 ' O ' HG12 ' B' ' 42' ' ' VAL . 76.8 t -48.57 -44.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.428 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 52.8 m -58.49 -34.21 70.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.842 0.353 . . . . 0.0 110.434 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.0 m -82.25 -45.96 14.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.759 0.79 . . . . 0.0 111.372 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.463 ' CD1' ' CZ ' ' B' ' 55' ' ' ARG . 3.2 mm? -64.21 -43.55 94.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.619 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 38' ' ' VAL . 4.3 p -68.17 -20.4 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.054 0.455 . . . . 0.0 109.981 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -98.84 -15.6 19.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -55.64 -47.73 76.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -174.8 126.67 0.29 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 110.565 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 25.0 mt -97.31 39.14 1.2 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.258 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -63.69 -25.35 68.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.684 0.754 . . . . 0.0 110.322 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.727 ' O ' HG22 ' B' ' 51' ' ' VAL . 34.5 tptt -169.41 115.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.826 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 48.4 p30 -50.21 -14.29 0.15 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.174 -0.61 . . . . 0.0 110.985 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.473 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -78.31 -55.1 5.51 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 119.905 -0.718 . . . . 0.0 112.292 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.727 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.3 m -48.35 -37.97 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.837 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -76.35 -33.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.588 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.438 HD13 ' O ' ' B' ' 53' ' ' LEU . 0.2 OUTLIER -62.41 -38.33 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.363 -178.671 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -67.58 -47.15 70.57 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.338 0.59 . . . . 0.0 110.298 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.463 ' CZ ' ' CD1' ' B' ' 41' ' ' LEU . 54.8 mtp180 -61.8 -42.89 99.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.2 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.31 -45.02 94.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.218 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -52.11 -37.78 55.28 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.2 -33.84 76.24 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.02 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.6 ' O ' HD13 ' B' ' 59' ' ' LEU . 0.3 OUTLIER -58.45 -40.82 83.66 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.386 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -51.86 -27.25 12.07 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.961 0.41 . . . . 0.0 110.095 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.31 -40.94 98.73 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.34 -53.54 12.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.834 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.39 -43.05 44.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.058 0.456 . . . . 0.0 109.961 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -64.53 -34.77 79.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.137 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -63.68 -34.37 77.71 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.418 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 99.7 t -65.94 -43.0 92.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 122.058 0.932 . . . . 0.0 110.383 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.598 ' HD2' HD11 ' B' ' 27' ' ' ILE . 19.2 mmmt -66.74 -46.01 76.8 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.207 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -76.24 -19.23 58.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.29 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.98 -33.72 9.46 Favored Glycine 0 N--CA 1.471 1.017 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -88.05 -176.48 5.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.4 . . . . 0.0 110.265 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 9.5 m -174.21 -178.97 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.365 0.602 . . . . 0.0 110.079 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -99.41 -36.96 9.41 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.34 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.3 157.43 16.61 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.501 0.667 . . . . 0.0 110.025 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -145.96 84.61 1.66 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.292 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -70.85 122.4 19.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.279 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.423 ' CG ' ' N ' ' B' ' 77' ' ' HIS . 84.2 t60 -171.33 161.6 6.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.439 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.423 ' N ' ' CG ' ' B' ' 76' ' ' HIS . 57.7 t-80 -72.12 133.3 45.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.451 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -66.97 130.98 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -70.96 133.54 46.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.559 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.567 -179.9 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.529 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 3' ' ' GLU . 49.3 m -87.09 -6.06 58.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.42 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 2' ' ' SER . 23.7 mp0 56.7 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.649 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -178.42 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.399 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -63.16 -37.74 88.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.05 0.452 . . . . 0.0 110.306 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m -61.85 133.57 55.63 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.079 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.515 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -60.08 -44.8 97.41 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.007 179.453 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 77.3 Cg_exo -48.58 -22.68 4.56 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.645 1.564 . . . . 0.0 112.169 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -73.6 -27.2 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.519 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' O ' ' CD1' ' A' ' 14' ' ' LEU . 1.0 OUTLIER -82.96 -30.38 28.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.135 179.663 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mt -74.05 -52.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 121.691 0.758 . . . . 0.0 111.189 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -52.12 -21.68 3.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.397 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -67.94 -37.18 81.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.684 ' N ' HD12 ' A' ' 14' ' ' LEU . 6.4 mp -69.97 -38.18 76.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.118 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.91 -36.7 72.83 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.883 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.56 -27.12 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -70.48 -53.34 16.68 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.983 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.0 pt -71.43 -40.43 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.088 0.47 . . . . 0.0 110.586 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -65.3 -53.08 49.22 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.889 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.412 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 40.9 mtt -100.16 -65.22 0.98 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.095 0.474 . . . . 0.0 110.33 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 20' ' ' MET . 19.6 t30 79.02 43.58 0.07 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.933 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -55.41 -44.94 76.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.054 0.454 . . . . 0.0 110.491 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.3 p -150.75 67.37 0.94 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.632 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -166.9 -137.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.536 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -148.22 -163.6 1.82 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.159 0.504 . . . . 0.0 110.354 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.473 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.0 tttm -85.91 -109.89 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.1 mt -62.25 -40.95 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -54.94 -21.35 11.44 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.539 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.18 -39.86 30.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.25 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.583 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.2 -46.1 88.59 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.571 179.171 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.583 ' N ' ' SD ' ' A' ' 30' ' ' MET . 9.8 t-20 -55.89 -47.89 76.59 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.658 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.8 p -65.63 -53.39 42.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.804 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE2' HD11 ' A' ' 14' ' ' LEU . 73.3 t80 -62.14 -47.29 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.689 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 30' ' ' MET . 48.2 t80 -57.51 -48.48 79.16 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.697 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' NH2' ' CD2' ' B' ' 63' ' ' TYR . 6.4 tpt180 -64.32 -30.62 71.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.797 0.332 . . . . 0.0 110.36 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.8 t -69.93 -43.02 72.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.15 -63.15 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.769 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.517 HG23 ' N ' ' A' ' 39' ' ' SER . 30.9 m -47.21 -42.15 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.678 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG23 ' A' ' 38' ' ' VAL . 58.4 m -56.13 -40.36 73.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.828 0.346 . . . . 0.0 110.242 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -71.89 -43.3 65.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.702 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.402 HD22 ' HD2' ' A' ' 55' ' ' ARG . 90.8 mt -62.71 -46.16 89.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.361 -179.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 92.8 t -65.67 -33.1 61.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.096 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -78.9 -18.3 54.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.26 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.938 ' O ' ' O ' ' A' ' 45' ' ' GLN . 42.8 t0 -65.88 169.14 6.98 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 121.217 0.532 . . . . 0.0 109.711 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.938 ' O ' ' O ' ' A' ' 44' ' ' ASP . 18.2 pt20 -13.12 -131.64 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.698 0 CA-C-O 118.51 -0.757 . . . . 0.0 112.684 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 173.75 35.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 118.379 0.536 . . . . 0.0 110.066 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.485 ' HB ' HG21 ' A' ' 51' ' ' VAL . 2.6 m -47.32 -49.58 23.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.209 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.717 ' O ' HG22 ' A' ' 51' ' ' VAL . 16.0 tptp -169.84 134.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.408 ' HA ' HD21 ' A' ' 49' ' ' ASN . 10.9 m120 -48.98 -16.04 0.12 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.421 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.467 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -78.44 -54.82 5.76 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.489 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 48' ' ' LYS . 23.9 m -49.99 -39.29 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.534 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.3 m -77.5 -40.27 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.171 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.1 -37.61 87.89 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.81 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -58.83 -42.16 88.61 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.163 -179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.402 ' HD2' HD22 ' A' ' 41' ' ' LEU . 40.6 ttm180 -70.63 -40.94 72.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.442 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.41 -50.37 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.427 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -57.0 -38.55 73.25 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 55.5 m170 -69.0 -38.7 79.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.735 0.303 . . . . 0.0 110.355 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.48 -24.93 14.39 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.62 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 15.2 p-10 -51.56 -28.36 13.64 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.469 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.452 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 9.1 pt-20 -63.47 -31.9 73.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.504 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.66 -60.12 2.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.505 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -39.7 60.58 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.089 0.471 . . . . 0.0 110.415 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.1 -38.82 91.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.481 -178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.3 mmtt -63.35 -33.02 74.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.319 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.58 -46.25 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.523 0.678 . . . . 0.0 110.509 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HZ3' ' HB3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -66.83 -43.19 84.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.471 -179.363 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -87.3 2.63 49.64 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.035 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.08 -38.55 1.13 Allowed Glycine 0 N--CA 1.478 1.473 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.473 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 pp20? -56.69 -35.13 68.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.708 0.29 . . . . 0.0 110.273 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 70' ' ' GLU . 11.9 p -60.18 144.35 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.188 0.518 . . . . 0.0 110.308 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -164.86 37.18 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.802 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.527 HD12 ' N ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -97.67 -3.92 38.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.387 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.527 ' N ' HD12 ' A' ' 73' ' ' LEU . 8.3 pt-20 -99.51 -122.0 0.15 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 52.52 13.85 0.35 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.95 0.405 . . . . 0.0 110.648 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.402 ' N ' ' C ' ' A' ' 74' ' ' GLU . 86.3 t60 -91.29 -88.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.245 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 0.455 ' O ' ' O ' ' A' ' 78' ' ' HIS . 85.9 t60 -170.27 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.506 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' HIS . . . . . 0.455 ' O ' ' O ' ' A' ' 77' ' ' HIS . 82.5 t60 58.76 140.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.611 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -57.19 -77.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.885 0.374 . . . . 0.0 110.553 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.5 t60 . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.579 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.3 mmt . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' SER . . . . . 0.42 ' O ' ' O ' ' B' ' 3' ' ' GLU . 77.1 p -64.67 -32.9 74.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.671 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' B' ' 2' ' ' SER . 79.8 tt0 59.44 144.49 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.435 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 8.2 tp -170.86 -32.73 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.687 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -59.91 -44.58 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.325 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -62.85 130.8 46.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.171 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.514 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.86 -44.23 94.18 Favored Pre-proline 0 CA--C 1.543 0.685 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.957 179.42 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.7 Cg_exo -50.03 -21.68 6.72 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 121.703 1.602 . . . . 0.0 112.21 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.94 -42.73 94.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.922 0.391 . . . . 0.0 110.497 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.451 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.9 m-85 -60.8 -43.47 98.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.291 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.37 -43.53 97.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.262 0.553 . . . . 0.0 110.472 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -51.34 -28.39 12.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.501 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.44 -35.7 73.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.212 0.529 . . . . 0.0 110.575 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 37.9 mt -67.68 -38.33 83.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.462 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -56.49 -40.77 75.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 20' ' ' MET . 55.5 tt0 -66.56 -34.86 78.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.323 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -64.0 -51.68 63.11 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.754 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.599 HD11 ' OE2' ' B' ' 70' ' ' GLU . 11.0 pt -73.13 -40.9 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.111 0.481 . . . . 0.0 110.71 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -72.03 -52.51 16.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.773 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.431 ' N ' ' O ' ' B' ' 16' ' ' GLN . 15.3 tpp -87.05 -63.84 1.24 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.16 0.505 . . . . 0.0 110.45 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 69.85 40.77 1.26 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.92 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -53.56 -35.2 60.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.058 0.456 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -165.59 64.44 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.657 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -158.6 -132.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.333 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -153.05 -176.27 5.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.548 0.689 . . . . 0.0 110.081 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -80.81 -105.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.561 ' O ' ' SD ' ' B' ' 30' ' ' MET . 5.3 mm -60.33 -39.84 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -69.21 18.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.096 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.82 -49.51 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.381 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.561 ' SD ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -56.31 -38.01 70.7 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.386 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.54 ' N ' ' SD ' ' B' ' 30' ' ' MET . 58.5 t-20 -50.69 -44.11 57.83 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.321 -178.052 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.7 t -74.46 -54.97 6.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.719 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.451 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 88.2 t80 -59.04 -49.8 76.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.535 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.539 ' N ' ' O ' ' B' ' 30' ' ' MET . 22.7 t80 -55.31 -45.47 76.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -63.98 -33.86 76.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 34.3 t -68.56 -45.08 73.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.503 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' B' ' 41' ' ' LEU . 88.4 t -67.95 -62.7 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.305 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.52 HG13 ' N ' ' B' ' 39' ' ' SER . 8.0 p -48.17 -44.39 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.607 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.52 ' N ' HG13 ' B' ' 38' ' ' VAL . 50.8 p -57.82 -57.9 10.73 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.054 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.3 m -73.59 -43.19 60.34 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 122.39 1.09 . . . . 0.0 111.287 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' B' ' 37' ' ' VAL . 41.8 tp -54.14 -41.57 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.37 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -80.46 -16.55 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -83.21 -17.09 43.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.465 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.507 ' CG ' ' H ' ' B' ' 45' ' ' GLN . 24.5 t0 -104.75 -151.87 0.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.103 0.477 . . . . 0.0 109.715 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.507 ' H ' ' CG ' ' B' ' 44' ' ' ASP . 11.4 tp-100 31.9 -93.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.152 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ASP . 10.3 mt 54.37 75.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.178 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -136.27 -25.54 1.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.579 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -165.06 128.78 2.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -49.48 -33.57 14.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.475 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -71.63 -49.98 35.03 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.021 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 t -50.58 -45.2 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.379 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.5 -35.88 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.804 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 55.3 tp -62.58 -39.79 94.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.486 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.476 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 93.9 mttt -58.41 -43.01 88.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.23 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -68.74 -40.61 79.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.2 -51.38 73.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -54.23 -39.15 66.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.212 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 32.2 m170 -67.54 -35.05 78.31 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.264 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.512 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.8 OUTLIER -60.99 -37.65 83.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.254 -179.298 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -55.77 -32.71 63.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.417 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -58.96 -35.12 72.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.503 . . . . 0.0 110.453 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.62 19.03 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.85 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.615 ' CD2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -52.1 -50.14 62.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.302 0.572 . . . . 0.0 109.746 -179.537 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.4 t30 -62.44 -32.07 72.88 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.377 -178.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -60.57 -36.76 79.3 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.228 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 59.3 t -64.39 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 123.333 1.54 . . . . 0.0 110.863 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.603 ' C ' ' H ' ' B' ' 69' ' ' GLY . 7.2 mmmt -72.31 -30.67 65.0 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 113.637 -1.619 . . . . 0.0 111.496 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 49.2 ttt85 -55.02 1.06 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.608 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.603 ' H ' ' C ' ' B' ' 67' ' ' LYS . . . 97.19 18.53 28.68 Favored Glycine 0 N--CA 1.46 0.235 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.599 ' OE2' HD11 ' B' ' 18' ' ' ILE . 0.0 OUTLIER -59.88 -26.53 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.499 0.666 . . . . 0.0 110.145 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.533 ' HA ' HD12 ' B' ' 18' ' ' ILE . 7.4 t -81.91 -15.34 54.25 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.561 -178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -135.45 24.56 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.532 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' B' ' 75' ' ' HIS . 58.7 tp -62.53 -70.89 0.18 Allowed 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.633 0.73 . . . . 0.0 110.084 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 76' ' ' HIS . 54.3 mt-10 63.45 -57.55 0.18 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.935 0.874 . . . . 0.0 110.789 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.522 ' N ' ' O ' ' B' ' 73' ' ' LEU . 83.4 t60 58.54 -77.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.606 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' B' ' 74' ' ' GLU . 84.1 t60 -160.48 133.58 6.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.415 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -161.09 139.93 10.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.538 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -74.68 144.44 43.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.412 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -65.09 -43.48 91.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.467 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 6.6 p80 . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 117.933 -1.032 . . . . 0.0 110.572 -179.971 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.2 p -160.21 164.02 33.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.079 0.466 . . . . 0.0 110.595 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -118.5 52.55 1.02 Allowed 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.696 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.4 -20.16 64.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.268 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -61.91 -44.32 97.03 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.119 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -72.29 135.45 45.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.315 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.578 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -68.78 -40.18 16.61 Favored Pre-proline 0 CA--C 1.539 0.549 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.578 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 78.4 Cg_exo -52.08 -27.18 28.2 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 121.731 1.62 . . . . 0.0 111.883 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -61.71 -41.76 98.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -58.15 -39.04 77.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.053 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.634 HG21 ' HD3' ' A' ' 65' ' ' LYS . 54.6 mt -69.8 -45.91 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-O 121.451 0.644 . . . . 0.0 110.507 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -49.11 -24.09 1.5 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.806 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -74.92 -30.04 61.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.544 0.688 . . . . 0.0 110.695 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.426 HD21 ' CG ' ' A' ' 33' ' ' TYR . 25.1 mt -70.04 -39.5 75.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.601 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -51.22 -39.21 56.08 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.258 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -67.29 -36.52 81.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.406 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.62 -51.42 68.58 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.665 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' A' ' 19' ' ' GLU . 15.2 pt -73.84 -43.77 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.267 0.556 . . . . 0.0 110.958 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' A' ' 18' ' ' ILE . 83.8 tt0 -65.55 -54.3 30.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.672 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.5 mtt -101.03 -160.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 109.861 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -151.82 47.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.96 -49.05 74.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.0 p -176.2 65.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.404 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 12.4 tp10 -163.06 -137.02 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.98 0.419 . . . . 0.0 110.203 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -157.79 -166.96 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 110.16 -179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -81.81 -103.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.56 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.551 ' C ' ' H ' ' A' ' 29' ' ' ALA . 4.8 tt -65.12 -36.25 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.509 -179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 83.8 t60 -65.65 11.25 0.07 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.678 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.551 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -80.36 -44.39 19.52 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.921 0.391 . . . . 0.0 110.653 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.493 ' O ' ' N ' ' A' ' 34' ' ' TYR . 12.3 ptt? -58.8 -47.9 83.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.164 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' ' CG ' ' A' ' 30' ' ' MET . 69.6 m-20 -53.06 -53.91 43.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.809 -178.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.42 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 73.3 m -57.99 -51.25 70.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.512 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CE1' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -64.64 -25.52 67.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.124 179.274 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.493 ' N ' ' O ' ' A' ' 30' ' ' MET . 53.9 t80 -71.64 -55.43 7.76 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.054 0.454 . . . . 0.0 110.358 -178.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -65.98 -24.71 66.84 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.454 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -67.23 -51.61 51.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.69 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.45 -55.42 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.6 t -49.48 -53.32 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.662 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -50.35 -56.68 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.842 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 44' ' ' ASP . 18.9 m -61.51 -42.9 99.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.208 0.528 . . . . 0.0 110.521 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.771 HD21 HH11 ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.96 -44.4 94.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.409 -178.508 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 82.6 t -73.55 -40.0 54.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.027 0.442 . . . . 0.0 110.276 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -73.01 -21.39 60.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.708 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.595 ' CG ' ' H ' ' A' ' 45' ' ' GLN . 26.7 t70 -101.36 -152.07 0.43 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.097 0.475 . . . . 0.0 110.008 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.595 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 5.9 tp-100 30.42 -91.97 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.412 0.625 . . . . 0.0 111.425 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 44' ' ' ASP . 7.3 mt 56.74 101.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.041 178.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.519 HG22 HG21 ' A' ' 51' ' ' VAL . 12.1 t -168.29 -28.13 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.897 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.817 ' O ' HG22 ' A' ' 51' ' ' VAL . 38.1 tptt -164.15 129.38 2.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.87 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 59.1 m-20 -51.52 -18.1 1.01 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.989 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -75.9 -57.04 4.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.869 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.817 HG22 ' O ' ' A' ' 48' ' ' LYS . 28.7 m -46.64 -36.31 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.755 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 51' ' ' VAL . 34.1 m -81.72 -33.76 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 178.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 39.4 tp -57.3 -55.86 29.34 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.444 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 18.9 ptmt -52.62 -42.55 64.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.317 0.58 . . . . 0.0 110.291 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.771 HH11 HD21 ' A' ' 41' ' ' LEU . 25.8 mmt85 -61.14 -40.95 95.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.753 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.1 mm -69.68 -49.57 57.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.312 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.7 mt-30 -56.02 -46.08 78.92 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.495 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -66.98 -45.32 78.0 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.245 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.578 HD11 ' CE1' ' A' ' 33' ' ' TYR . 38.8 tp -50.2 -24.86 3.09 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.794 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -62.93 -32.99 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.241 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -62.34 -39.55 93.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.715 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -58.29 5.71 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.571 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -54.05 -42.07 68.82 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 109.877 -179.729 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.418 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 59.8 t-20 -66.02 -40.87 91.44 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.588 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.634 ' HD3' HG21 ' A' ' 11' ' ' ILE . 62.7 tttm -61.49 -39.59 91.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.44 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.0 t -53.55 -59.88 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.454 -179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.407 ' C ' ' N ' ' A' ' 69' ' ' GLY . 32.0 mtmt -62.45 -46.42 88.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.977 0.894 . . . . 0.0 111.437 -179.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -52.11 -15.67 0.62 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.052 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.407 ' N ' ' C ' ' A' ' 67' ' ' LYS . . . -101.16 -13.76 32.67 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -100.79 -101.41 0.25 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.648 0.261 . . . . 0.0 110.369 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 t 52.96 36.82 22.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.227 0.537 . . . . 0.0 110.658 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -97.98 -21.72 16.68 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.51 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 30.4 mt -95.58 0.78 53.32 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.462 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -160.26 44.44 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -64.44 -50.19 68.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.323 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.0 m80 47.23 -172.48 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.581 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -106.1 124.56 49.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.155 0.502 . . . . 0.0 110.311 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -74.21 144.43 44.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.28 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 76.3 m80 52.93 85.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.639 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.4 t60 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.473 -179.876 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mmm . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 97.1 p -159.95 158.96 31.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 tp10 -80.17 134.28 36.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.155 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 mt 51.76 -165.58 0.05 Allowed 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.619 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.515 ' O ' ' CB ' ' B' ' 6' ' ' SER . 98.1 m-85 44.26 77.39 0.07 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.33 0.586 . . . . 0.0 109.997 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.515 ' CB ' ' O ' ' B' ' 5' ' ' PHE . 2.3 p 152.33 77.89 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.243 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.476 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 3.5 t -35.25 -54.67 1.12 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.076 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 19.3 Cg_endo -53.37 -22.24 20.24 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 121.366 1.377 . . . . 0.0 112.44 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' B' ' 6' ' ' SER . 12.4 t80 -66.98 -44.76 79.6 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.769 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.1 m-85 -71.66 -46.42 58.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.759 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 40.1 mt -61.14 -44.83 99.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.275 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -49.8 -31.39 11.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.231 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ASN . . . . . 0.465 ' ND2' ' NE2' ' B' ' 17' ' ' HIS . 5.4 t-20 -71.38 -43.44 66.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.386 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' B' ' 33' ' ' TYR . 46.2 mt -62.67 -39.09 92.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.244 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.258 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -75.2 -28.22 59.92 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.014 0.435 . . . . 0.0 110.696 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.465 ' NE2' ' ND2' ' B' ' 13' ' ' ASN . 34.7 m170 -65.43 -51.49 59.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' B' ' 19' ' ' GLU . 3.7 pt -73.08 -44.55 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.085 0.469 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 19' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' B' ' 18' ' ' ILE . 72.0 mm-40 -67.48 -50.43 59.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.129 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.0 tpp -94.0 -152.81 0.35 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.538 0.685 . . . . 0.0 109.98 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.97 41.92 0.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.003 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -55.25 -50.5 69.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.237 0.541 . . . . 0.0 110.491 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 36.7 p -174.62 65.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.289 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -162.86 -146.9 0.11 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.913 0.387 . . . . 0.0 110.403 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -144.44 -163.41 1.68 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.113 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -81.54 -108.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.5 mt -64.72 -42.26 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -50.16 -28.79 7.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.82 -31.67 1.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.728 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -65.82 -50.69 63.71 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.355 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' B' ' 30' ' ' MET . 10.8 t30 -57.56 -56.73 18.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.964 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 63.7 p -54.54 -45.57 73.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 76.3 t80 -70.15 -34.53 73.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.538 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' B' ' 30' ' ' MET . 25.3 t80 -61.65 -47.81 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.612 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.482 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.7 mpt_? -69.51 -26.48 64.55 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -68.68 -46.38 69.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.8 t -64.89 -66.12 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.544 -0.863 . . . . 0.0 110.835 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.491 HG23 ' N ' ' B' ' 39' ' ' SER . 25.1 m -44.6 -39.82 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.577 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.491 ' N ' HG23 ' B' ' 38' ' ' VAL . 11.0 t -60.73 -44.93 96.02 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.142 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.7 m -69.67 -46.47 66.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 0.0 110.998 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.413 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -60.28 -33.74 72.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.46 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -87.63 -37.58 10.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -73.12 -14.97 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.672 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' B' ' 41' ' ' LEU . 33.6 t70 -143.67 160.52 40.55 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.484 0.659 . . . . 0.0 110.051 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 41.25 63.35 1.25 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.083 -179.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.87 42.11 1.68 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.56 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' THR . . . . . 0.493 HG22 HG21 ' B' ' 51' ' ' VAL . 9.1 t -54.92 -44.01 73.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.764 0.792 . . . . 0.0 110.455 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.809 ' O ' HG22 ' B' ' 51' ' ' VAL . 38.2 tptt -146.81 127.44 14.22 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.881 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -50.19 -15.03 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.939 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.409 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -77.08 -55.79 5.14 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.596 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.809 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.2 m -48.08 -38.0 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.773 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.68 -34.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.144 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.14 -42.25 90.24 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.427 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -56.29 -43.81 79.23 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.018 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.29 -45.06 93.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.93 -52.04 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.786 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -55.32 -41.39 72.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.391 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.21 -38.83 63.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.331 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 5.8 tt -52.63 -26.2 12.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.082 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -52.43 -28.59 20.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.438 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.46 -32.85 74.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.91 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.75 -62.92 1.21 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.748 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.49 -38.97 14.87 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -65.07 -38.55 91.15 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.128 0.49 . . . . 0.0 110.071 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 65' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.2 tptp -63.33 -33.07 74.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.179 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 60.6 t -62.57 -46.75 95.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.928 0.87 . . . . 0.0 110.466 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -71.52 -43.0 67.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.203 1.001 . . . . 0.0 112.011 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 29.6 mmm-85 -79.09 -14.14 59.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.478 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -95.88 -42.12 3.65 Favored Glycine 0 N--CA 1.469 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -67.14 -31.75 72.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.802 0.334 . . . . 0.0 110.329 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -71.83 150.28 44.45 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.109 0.48 . . . . 0.0 110.03 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.431 ' O ' ' C ' ' B' ' 73' ' ' LEU . 31.0 mmtp 45.02 -167.55 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.067 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.431 ' C ' ' O ' ' B' ' 72' ' ' LYS . 1.5 tt 34.35 69.99 0.14 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.976 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -67.3 -50.56 59.75 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.345 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.462 ' O ' ' CG ' ' B' ' 76' ' ' HIS . 84.8 t60 -171.83 144.47 1.78 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.481 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.462 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 58.9 m80 -157.75 108.94 2.26 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.433 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 77' ' ' HIS . . . . . 0.405 ' ND1' ' O ' ' B' ' 78' ' ' HIS . 60.2 t-80 -157.88 146.33 19.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.405 ' O ' ' ND1' ' B' ' 77' ' ' HIS . 75.1 m80 -70.3 137.34 50.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.379 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -70.95 156.95 39.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.483 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.887 -179.807 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 ptt? . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.7 p 50.7 97.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.401 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.532 ' C ' ' H ' ' A' ' 5' ' ' PHE . 4.6 tt0 57.03 -168.87 0.11 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.623 0.725 . . . . 0.0 110.0 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 45.4 tp 67.79 -39.93 0.4 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.56 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.532 ' H ' ' C ' ' A' ' 3' ' ' GLU . 74.3 t80 -59.61 -44.53 93.38 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m -65.54 125.48 25.34 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.22 0.533 . . . . 0.0 110.352 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.528 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -52.42 -50.25 80.97 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.143 179.07 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 58.1 Cg_exo -41.59 -27.64 0.53 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 121.845 1.697 . . . . 0.0 112.32 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -60.48 -39.43 87.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 110.205 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.8 m-85 -58.05 -47.05 84.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -66.1 -47.14 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.465 0.65 . . . . 0.0 110.62 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -50.61 -28.55 8.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.62 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -72.36 -37.78 68.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.37 0.605 . . . . 0.0 110.648 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 14.3 mt -67.53 -35.19 78.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.163 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -52.16 -41.85 62.92 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.34 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -68.01 -36.46 80.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.834 0.35 . . . . 0.0 110.675 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.1 -49.3 78.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.721 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.451 HG13 ' N ' ' A' ' 19' ' ' GLU . 27.0 pt -73.24 -41.43 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.783 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.451 ' N ' HG13 ' A' ' 18' ' ' ILE . 47.6 tp10 -55.06 -53.98 48.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.311 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 17.9 ptp -121.25 -134.59 0.31 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.241 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -159.88 53.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.159 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -55.7 -46.41 77.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.3 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.0 p -175.42 57.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -164.71 -139.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.285 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -147.86 -166.3 2.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.349 0.595 . . . . 0.0 110.54 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.5 -105.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.471 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.5 HG23 ' N ' ' A' ' 28' ' ' HIS . 17.4 tt -63.96 -41.83 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.163 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.5 ' N ' HG23 ' A' ' 27' ' ' ILE . 95.5 m-70 -55.65 -11.58 0.97 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.592 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.84 -42.83 48.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.593 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.1 ptm -65.98 -54.76 22.03 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.194 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 30' ' ' MET . 19.0 t-20 -51.61 -47.83 63.48 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.495 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.9 t -68.31 -54.54 16.72 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.648 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.412 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 42.8 t80 -60.63 -48.97 79.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.642 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.739 ' O ' HG23 ' A' ' 38' ' ' VAL . 66.3 t80 -51.88 -43.27 63.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.791 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.6 ttm-85 -77.16 -26.58 53.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.0 m -64.79 -46.83 80.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.771 -179.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.526 HG23 ' N ' ' A' ' 38' ' ' VAL . 26.6 m -76.23 -44.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 34' ' ' TYR . 24.6 t -46.61 -43.33 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.207 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.0 p -58.61 -35.09 71.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.029 0.443 . . . . 0.0 110.506 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 44' ' ' ASP . 95.6 m -85.82 -45.22 11.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.723 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' C ' ' H ' ' A' ' 43' ' ' GLN . 4.4 mm? -63.21 -45.73 90.31 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.039 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 38' ' ' VAL . 2.8 p -68.67 3.99 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.294 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 41' ' ' LEU . 57.1 tt0 -129.28 -23.34 2.98 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.255 -179.474 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 40' ' ' THR . 23.4 t0 -57.79 121.88 11.54 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.25 0.548 . . . . 0.0 110.035 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.452 ' C ' ' O ' ' A' ' 44' ' ' ASP . 11.2 pt20 31.58 89.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.281 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.23 45.71 0.47 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.393 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -59.17 -31.37 68.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.388 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 5.8 ttmt -165.79 131.21 2.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.228 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -50.04 -32.1 14.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.404 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.508 ' N ' HD22 ' B' ' 49' ' ' ASN . . . -72.42 -48.72 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.386 0.612 . . . . 0.0 110.601 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.1 t -49.13 -42.42 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.751 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.402 ' H ' HG22 ' A' ' 52' ' ' VAL . 25.6 m -75.44 -36.36 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.209 0.528 . . . . 0.0 110.295 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -35.82 82.19 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.471 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 59.3 mttp -53.26 -41.98 66.04 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.301 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -65.26 -36.66 84.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.321 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 41.2 mm -66.84 -51.67 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.738 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 77.6 mt-30 -55.37 -40.26 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.348 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.471 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 38.1 m80 -75.73 -40.05 56.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.546 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD23 ' CE1' ' A' ' 34' ' ' TYR . 62.2 tp -51.51 -30.89 21.87 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.742 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 11.6 p-10 -52.88 -28.4 22.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.38 0.609 . . . . 0.0 110.624 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.549 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.7 pt-20 -57.93 -36.66 72.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.366 -179.448 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -71.6 -53.82 12.47 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.4 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.441 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.95 -41.36 33.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.208 -179.842 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.441 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 39.5 m-80 -68.09 -41.64 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -65.53 -34.81 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.433 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 62' ' ' ALA . 89.7 t -60.78 -62.31 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.513 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -60.71 -51.86 67.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.349 -0.54 . . . . 0.0 111.148 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 -55.43 -11.86 0.95 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.179 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.83 -28.41 6.62 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -53.77 -100.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.693 0.282 . . . . 0.0 110.638 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -164.83 -131.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.342 0.591 . . . . 0.0 110.215 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -65.8 -130.96 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.355 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 73' ' ' LEU . 11.1 mp 44.85 58.77 3.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.686 -179.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.418 ' O ' ' O ' ' A' ' 75' ' ' HIS . 6.3 pt-20 -148.82 -36.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.653 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.418 ' O ' ' O ' ' A' ' 74' ' ' GLU . 0.9 OUTLIER 59.62 146.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.982 0.42 . . . . 0.0 110.363 -179.759 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -115.62 45.36 1.7 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -110.83 110.03 20.47 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.206 0.527 . . . . 0.0 110.397 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -157.44 156.47 32.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.556 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -68.01 130.35 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.582 -179.962 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 34.9 t -64.91 -26.37 68.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.4 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -74.0 139.07 44.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.688 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.41 HD12 ' N ' ' B' ' 5' ' ' PHE . 0.4 OUTLIER -161.21 9.47 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.392 -179.586 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.41 ' N ' HD12 ' B' ' 4' ' ' LEU . 60.1 t80 -59.9 -44.36 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.014 0.435 . . . . 0.0 110.33 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.48 131.73 50.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.302 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.713 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 25.3 t -58.81 -48.58 96.56 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.257 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.713 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 7.4 Cg_endo -47.5 -25.76 5.55 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.969 1.779 . . . . 0.0 112.077 -179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.45 -41.23 98.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.217 0.532 . . . . 0.0 110.449 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.434 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.5 m-85 -59.36 -40.65 87.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.253 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.3 mt -70.04 -43.47 79.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.306 0.574 . . . . 0.0 110.501 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -50.63 -28.78 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.542 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -73.25 -33.28 65.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.034 0.445 . . . . 0.0 110.483 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.431 HD13 ' CG2' ' B' ' 66' ' ' VAL . 25.7 mt -72.0 -38.95 69.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.545 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -56.74 -38.61 72.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.191 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.435 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.7 tt0 -66.98 -35.81 80.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.533 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -63.22 -51.86 64.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.949 0.404 . . . . 0.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.438 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.8 pt -72.53 -44.42 61.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.787 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' GLU . . . . . 0.438 ' N ' HG13 ' B' ' 18' ' ' ILE . 83.2 tt0 -68.85 -53.98 18.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.435 ' N ' ' O ' ' B' ' 16' ' ' GLN . 11.2 tpp -86.75 -153.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.196 0.522 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -162.27 36.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.515 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -46.06 -63.16 1.05 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.995 0.426 . . . . 0.0 110.637 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -172.41 65.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.48 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 19.1 tp10 -154.92 -131.33 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.025 0.44 . . . . 0.0 110.359 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -160.37 -173.86 4.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.343 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' LYS . . . . . 0.462 ' NZ ' ' OE2' ' B' ' 74' ' ' GLU . 85.9 tttt -74.35 -106.36 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.604 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.562 ' C ' ' H ' ' B' ' 29' ' ' ALA . 19.0 mt -66.0 -33.49 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -64.01 8.67 0.09 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.859 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.562 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.46 -43.56 31.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.742 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.417 ' CG ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -58.82 -46.86 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.058 -179.749 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -51.99 -48.75 64.27 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.393 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 65.7 p -67.78 -55.68 12.13 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.907 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.622 ' CE2' HG21 ' B' ' 37' ' ' VAL . 86.2 t80 -56.78 -47.49 80.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.596 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -58.16 -44.2 87.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.936 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -61.97 -35.46 78.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.281 0.563 . . . . 0.0 110.788 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.2 p -73.92 -44.25 55.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.66 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.622 HG21 ' CE2' ' B' ' 33' ' ' TYR . 50.0 t -69.96 -57.1 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.619 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.475 HG13 ' N ' ' B' ' 39' ' ' SER . 5.8 p -48.61 -41.52 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.033 0.444 . . . . 0.0 110.396 -179.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.475 ' N ' HG13 ' B' ' 38' ' ' VAL . 42.6 t -64.67 -38.17 90.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.265 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 44' ' ' ASP . 89.0 m -71.95 -44.06 64.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.385 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.66 -44.04 80.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -73.37 -32.4 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -77.65 -35.11 52.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.218 0.532 . . . . 0.0 110.61 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 40' ' ' THR . 98.8 m-20 -39.12 -68.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -174.53 139.67 0.58 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.556 ' N ' HD12 ' B' ' 46' ' ' LEU . 9.5 mp -96.04 48.32 1.11 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.341 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -61.56 -36.01 79.4 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.004 0.43 . . . . 0.0 110.6 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.527 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -166.61 128.48 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.62 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 24.4 p30 -47.91 -34.65 9.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.572 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.527 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -65.79 -49.59 67.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.007 0.432 . . . . 0.0 110.813 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' B' ' 54' ' ' LYS . 22.4 t -50.96 -43.98 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.71 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.2 m -80.68 -37.28 16.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.119 0.485 . . . . 0.0 110.65 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.15 -47.34 83.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.938 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.461 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.7 pttp -54.16 -41.29 68.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.579 0.704 . . . . 0.0 110.27 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.461 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 27.2 mmt180 -65.35 -37.91 88.48 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.136 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 6.0 mm -66.17 -48.56 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.684 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -56.18 -41.86 76.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.405 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -69.17 -38.9 78.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.384 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' LEU . . . . . 0.548 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.9 OUTLIER -53.83 -36.32 62.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.572 -178.894 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -53.82 -27.43 29.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.438 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -64.51 -37.95 89.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.452 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.6 -53.65 10.0 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.404 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -51.34 -39.63 57.43 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.056 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ASN . . . . . 0.453 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 49.7 t30 -71.02 -38.17 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.251 -178.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 43.0 mmtt -59.66 -32.13 70.19 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.438 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.431 ' CG2' HD13 ' B' ' 14' ' ' LEU . 98.7 t -64.67 -60.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.46 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -67.83 -45.13 75.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.372 0.606 . . . . 0.0 110.985 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -54.55 -23.21 15.68 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.313 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.89 -7.63 70.55 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -101.73 174.84 5.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.29 0.567 . . . . 0.0 110.37 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 37.1 t -161.9 -178.89 6.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.333 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -86.86 -44.12 11.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.469 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.526 ' N ' HD22 ' B' ' 73' ' ' LEU . 4.2 mm? -56.69 -50.35 72.39 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.838 -178.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.462 ' OE2' ' NZ ' ' B' ' 26' ' ' LYS . 96.9 mt-10 54.08 57.42 5.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.541 179.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.517 ' CG ' ' N ' ' B' ' 76' ' ' HIS . 82.7 t60 -62.3 169.11 3.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.396 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.517 ' N ' ' CG ' ' B' ' 75' ' ' HIS . 99.4 m-70 -75.37 64.2 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.495 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 51.0 m170 52.27 -168.51 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -152.24 54.65 0.81 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.545 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.6 p80 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.532 179.916 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.4 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.8 t -166.5 -76.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.512 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 51.12 79.11 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.365 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 tt -158.42 102.93 1.76 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.13 0.49 . . . . 0.0 110.322 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.47 67.28 2.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.178 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 29.8 t 51.73 -160.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.935 0.398 . . . . 0.0 110.578 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.538 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.6 t -51.71 -55.63 28.23 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.6 178.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 28.1 Cg_exo -36.12 -26.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.353 2.035 . . . . 0.0 112.479 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 7' ' ' VAL . 88.4 t80 -60.7 -43.11 98.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.394 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.433 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -56.46 -47.99 78.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.55 -45.09 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.415 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -51.65 -25.19 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.672 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.32 -36.4 74.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 110.48 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.615 ' N ' HD12 ' A' ' 14' ' ' LEU . 8.3 mp -68.41 -37.75 80.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.33 -39.35 86.77 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.259 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -55.23 -26.6 40.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.619 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -73.74 -53.74 9.66 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.849 -179.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -71.54 -42.89 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.493 0.664 . . . . 0.0 110.878 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.439 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 79.4 mm-40 -62.17 -53.03 61.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.179 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.3 mtt -103.05 -141.07 0.36 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.088 0.471 . . . . 0.0 110.081 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -169.84 56.5 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -51.61 63.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.193 0.52 . . . . 0.0 110.613 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 t 179.38 73.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.211 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.447 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 6.3 tp10 -164.6 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.995 0.426 . . . . 0.0 110.397 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -149.66 -172.18 4.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.46 0.648 . . . . 0.0 110.213 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 18' ' ' ILE . 59.7 tttp -79.75 -108.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.615 ' O ' ' SD ' ' A' ' 30' ' ' MET . 20.0 tt -61.52 -37.52 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.422 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.3 m-70 -69.56 20.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.067 0.46 . . . . 0.0 111.018 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.552 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -73.9 -45.91 47.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.615 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -59.66 -38.97 82.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.376 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.56 ' N ' ' SD ' ' A' ' 30' ' ' MET . 18.5 m120 -51.4 -44.96 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.272 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.447 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 6.8 t -73.32 -54.5 8.21 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.813 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.477 ' CD1' HD11 ' A' ' 14' ' ' LEU . 64.7 t80 -59.62 -50.66 73.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.542 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.1 t80 -54.9 -40.8 70.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.818 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.3 ttt-85 -72.33 -27.15 62.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.848 0.356 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -70.59 -44.37 67.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.404 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.518 ' O ' ' N ' ' A' ' 41' ' ' LEU . 59.3 t -66.09 -63.82 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.791 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.212 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 42' ' ' VAL . 26.3 m -47.18 -43.7 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.965 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.546 ' N ' HG23 ' A' ' 38' ' ' VAL . 11.5 t -53.27 -59.1 4.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 m -77.73 -41.55 37.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.993 0.902 . . . . 0.0 111.277 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 37' ' ' VAL . 40.7 tp -55.17 -41.34 71.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 38' ' ' VAL . 55.0 t -68.25 -3.85 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 120.912 0.387 . . . . 0.0 110.173 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.555 ' O ' ' C ' ' A' ' 44' ' ' ASP . 11.3 tp-100 -113.07 -29.56 7.28 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.035 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.555 ' C ' ' O ' ' A' ' 43' ' ' GLN . 46.7 t0 -17.81 -78.92 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.188 0.518 . . . . 0.0 111.341 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.421 ' O ' ' C ' ' A' ' 46' ' ' LEU . 27.5 pt20 -142.89 0.5 1.23 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.554 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' A' ' 45' ' ' GLN . 5.5 tp 34.18 50.39 0.36 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.099 0.476 . . . . 0.0 110.722 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -56.21 -28.49 58.51 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.606 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.529 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 62.2 tttp -178.66 143.92 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.324 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -57.71 -38.82 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.694 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.529 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -68.44 -49.88 56.69 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.75 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 t -51.15 -65.08 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.08 -31.95 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.275 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.52 -42.52 98.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.101 0.476 . . . . 0.0 110.402 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -59.99 -40.28 88.61 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.134 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -66.63 -39.45 88.29 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.317 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.25 -48.88 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.66 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -57.15 -33.02 66.98 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.134 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 4.6 t-80 -74.54 -40.49 61.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.027 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.2 -29.24 63.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.067 0.46 . . . . 0.0 110.532 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -51.38 -30.65 19.63 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.75 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 7.5 pt-20 -60.72 -28.97 69.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.21 -59.67 2.74 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.368 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -42.98 66.71 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.348 0.594 . . . . 0.0 110.218 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -62.69 -39.02 92.66 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.2 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -63.6 -38.53 91.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.502 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.04 -50.89 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-O 121.336 0.588 . . . . 0.0 110.355 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.88 -47.31 78.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.689 0.757 . . . . 0.0 111.304 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -56.16 -18.38 9.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.071 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.44 -18.41 52.62 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -81.05 -100.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 77.7 p -73.28 98.34 2.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.012 0.434 . . . . 0.0 110.635 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -68.32 -106.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.34 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.457 ' C ' ' H ' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -89.11 63.03 6.47 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.373 0.606 . . . . 0.0 110.479 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.36 -3.43 0.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.067 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.457 ' H ' ' C ' ' A' ' 73' ' ' LEU . 64.7 t-80 -67.34 154.4 41.42 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.551 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' HIS . . . . . 0.436 ' N ' ' ND1' ' A' ' 75' ' ' HIS . 46.1 t-80 -158.87 -44.52 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.579 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -162.59 -42.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.607 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.9 t60 54.19 99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.579 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -57.73 124.3 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.416 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.505 179.893 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' B' ' 1' ' ' MET . 2.2 mpt? . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 38.6 m -67.14 142.53 57.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.331 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -113.84 47.81 1.14 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.633 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' LEU . . . . . 0.603 HD22 ' N ' ' B' ' 4' ' ' LEU . 3.6 mm? 50.98 -104.29 0.16 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.641 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 53.9 t80 63.28 -67.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.149 0.5 . . . . 0.0 110.45 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' SER . . . . . 0.536 ' N ' ' O ' ' B' ' 4' ' ' LEU . 1.3 m -60.6 113.75 2.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.482 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 67.1 t -55.37 -49.86 90.07 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.826 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 6.7 Cg_endo -46.7 -20.6 1.1 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.831 1.687 . . . . 0.0 112.296 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -60.17 -42.54 95.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.151 0.501 . . . . 0.0 110.489 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' PHE . . . . . 0.456 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.5 m-85 -58.52 -41.97 86.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.407 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 64.6 mt -67.65 -44.23 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 121.533 0.682 . . . . 0.0 110.464 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -51.61 -30.61 21.84 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.629 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.53 -32.05 70.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.115 0.483 . . . . 0.0 110.408 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.67 -39.35 70.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.293 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -55.85 -32.1 63.33 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.095 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.25 -30.61 68.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.522 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -67.87 -50.54 55.86 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 pt -72.73 -35.86 51.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 110.773 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -70.94 -54.34 11.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.43 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 28.8 ttp -99.03 -62.5 1.23 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.441 HD21 ' HA ' ' B' ' 25' ' ' ASP . 11.1 t-20 78.6 49.81 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.244 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -51.06 -41.34 59.85 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 110.844 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -165.44 65.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.235 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -154.43 -131.97 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.179 0.514 . . . . 0.0 110.405 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ASP . . . . . 0.441 ' HA ' HD21 ' B' ' 21' ' ' ASN . 69.1 m-20 -151.93 -175.59 5.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.46 0.648 . . . . 0.0 109.996 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -80.02 -104.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.95 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.641 HD11 ' HD2' ' B' ' 67' ' ' LYS . 15.8 tt -63.11 -37.12 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.243 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -63.13 -3.52 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.477 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.54 -46.52 83.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.407 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -63.96 -43.17 96.59 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.176 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.574 ' N ' ' SD ' ' B' ' 30' ' ' MET . 22.5 t-20 -52.48 -53.65 42.91 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.769 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 8.3 t -64.22 -53.51 48.11 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.823 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.456 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -59.22 -49.44 77.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.459 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.3 t80 -56.92 -47.24 81.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.821 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -65.06 -31.35 72.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.507 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.4 t -68.8 -42.85 76.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.646 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.11 -63.68 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.764 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.556 HG23 ' N ' ' B' ' 39' ' ' SER . 26.7 m -48.83 -44.46 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.41 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' SER . . . . . 0.556 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.9 p -60.7 -40.23 91.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.412 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 96.7 m -69.4 -46.76 66.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.121 0.486 . . . . 0.0 110.677 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' B' ' 44' ' ' ASP . 93.3 mt -60.35 -30.06 69.3 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.409 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -89.16 -39.69 12.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.154 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -69.38 -13.66 62.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 45' ' ' GLN . 71.8 m-20 -146.45 166.74 25.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.346 0.593 . . . . 0.0 109.564 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 15.5 tt0 79.22 -77.99 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.71 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 24.6 mt 41.11 37.88 0.64 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.017 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.1 t -72.34 -32.22 66.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.421 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.6 tttt -170.41 132.2 0.98 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.611 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.23 -40.67 59.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.786 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.421 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -62.9 -44.49 95.97 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.824 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.46 -44.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.569 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.462 HG23 ' N ' ' B' ' 53' ' ' LEU . 28.5 m -79.22 -44.96 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.246 0.546 . . . . 0.0 110.683 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.462 ' N ' HG23 ' B' ' 52' ' ' VAL . 58.4 tp -57.06 -57.02 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.823 -178.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 0.2 OUTLIER -50.9 -34.59 29.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.257 0.551 . . . . 0.0 110.502 -179.309 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt85 -71.81 -41.87 67.74 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.978 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.3 -53.42 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.523 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -58.19 -37.8 75.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.473 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 4.4 m-70 -73.41 -38.95 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.38 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 40.7 tp -55.64 -30.11 60.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.567 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -52.33 -28.28 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -59.62 -32.27 70.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.571 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -55.61 7.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.521 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -42.67 62.32 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.265 0.555 . . . . 0.0 110.397 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -63.92 -39.65 94.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.415 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.84 -38.25 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.468 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.8 t -62.14 -47.93 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' B' ' 27' ' ' ILE . 0.0 OUTLIER -66.04 -40.79 91.26 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 122.014 0.911 . . . . 0.0 111.296 -179.278 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -49.8 -25.79 3.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.312 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.84 -20.38 55.93 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' B' ' 67' ' ' LYS . 55.4 mm-40 -91.22 -139.63 0.16 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 0.0 110.057 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -62.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.488 0.661 . . . . 0.0 110.562 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.436 ' N ' ' O ' ' B' ' 70' ' ' GLU . 67.6 mttm 61.87 29.89 18.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.486 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' B' ' 73' ' ' LEU . 4.1 mm? -84.77 -50.39 7.63 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.967 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' B' ' 73' ' ' LEU . 27.2 mt-10 -34.65 -49.41 0.41 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.797 0.808 . . . . 0.0 110.903 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.547 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 13.7 t-80 -126.42 -118.89 0.26 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.801 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.547 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 58.4 t-80 -158.93 -50.75 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.428 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 67.2 m80 52.01 84.36 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.519 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' HIS . . . . . 0.443 ' O ' ' CG ' ' B' ' 79' ' ' HIS . 80.6 m80 -56.27 -78.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.474 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' B' ' 78' ' ' HIS . 96.8 m-70 -155.3 157.25 36.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.593 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.356 179.929 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t 51.53 55.55 9.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.618 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -65.86 -166.46 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.62 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tt -163.38 99.97 0.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.132 0.491 . . . . 0.0 110.578 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -102.07 83.51 2.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.346 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.9 p 43.68 -161.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.64 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.569 ' O ' ' N ' ' A' ' 9' ' ' TYR . 2.6 t -53.69 -55.21 37.77 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.043 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 77.6 Cg_exo -34.94 -25.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.391 2.06 . . . . 0.0 112.933 -179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.569 ' N ' ' O ' ' A' ' 7' ' ' VAL . 82.9 t80 -56.37 -40.16 74.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -61.82 -45.66 92.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.563 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.11 -43.68 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.427 0.632 . . . . 0.0 110.552 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -48.63 -23.74 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.397 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -74.18 -35.33 63.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.172 0.511 . . . . 0.0 110.632 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.1 mt -68.28 -39.41 82.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.574 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -57.88 -40.09 79.43 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.595 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -65.95 -31.04 71.72 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -67.15 -52.39 42.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.093 0.473 . . . . 0.0 110.97 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 11.8 pt -72.82 -42.86 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.576 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 52.1 tp10 -62.07 -54.41 41.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.432 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 44.1 mtt -99.34 -139.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -170.3 49.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.232 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -58.12 -45.52 87.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.494 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 m 174.5 72.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.325 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.76 -136.77 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.115 0.483 . . . . 0.0 110.301 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -145.18 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.307 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -96.18 -108.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.357 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.599 ' O ' ' SD ' ' A' ' 30' ' ' MET . 10.3 tp -55.85 -36.75 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.01 0.433 . . . . 0.0 110.52 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.402 ' N ' HG23 ' A' ' 27' ' ' ILE . 56.2 m80 -81.42 20.51 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.526 -179.681 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.72 -52.8 26.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.49 . . . . 0.0 110.754 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.599 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.88 -32.92 72.34 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.249 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.52 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 51.3 t30 -51.68 -48.79 63.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.472 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.6 t -67.9 -52.88 31.27 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.744 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -60.67 -48.06 83.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.325 0.583 . . . . 0.0 110.936 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.576 ' CE1' HG21 ' A' ' 38' ' ' VAL . 54.4 t80 -55.18 -54.81 38.64 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.997 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.34 -35.63 76.1 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.438 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.5 t -63.04 -44.64 95.33 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.392 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.83 -56.6 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.5 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.576 HG21 ' CE1' ' A' ' 34' ' ' TYR . 90.5 t -54.79 -49.09 71.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.36 -178.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -60.34 -45.22 94.21 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.307 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 78.3 m -61.13 -48.78 80.03 Favored 'General case' 0 C--N 1.328 -0.37 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.544 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.86 -41.27 91.87 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.15 0.5 . . . . 0.0 110.743 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 42' ' ' VAL . 60.2 t -86.16 26.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.23 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -162.32 10.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -151.15 17.98 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.186 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -147.79 -79.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.669 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.9 mt 48.46 45.75 20.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.856 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -85.61 -27.15 25.64 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.465 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 tptm -173.02 132.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.975 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.44 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 76.2 m-20 -51.19 -45.79 61.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.513 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.6 -46.79 88.92 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.968 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.4 t -56.32 -46.3 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.084 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.573 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.3 m -78.48 -49.92 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-O 121.736 0.779 . . . . 0.0 110.333 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.6 ' C ' HD23 ' A' ' 53' ' ' LEU . 9.0 tt -52.77 -59.97 3.83 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.937 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -49.22 -34.77 15.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.342 0.592 . . . . 0.0 110.196 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.2 -38.77 91.5 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.962 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 52' ' ' VAL . 16.3 mm -65.52 -51.03 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.449 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -58.85 -40.7 85.06 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.506 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -72.62 -47.63 46.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.144 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.4 ' N ' ' ND1' ' A' ' 58' ' ' HIS . 37.6 tp -55.89 -33.69 64.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -56.76 -34.7 67.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.151 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.509 ' O ' ' ND2' ' A' ' 64' ' ' ASN . 4.7 pt-20 -52.84 -30.49 33.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.335 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.82 -42.0 35.22 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.553 0.692 . . . . 0.0 110.909 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.1 OUTLIER -56.17 -47.49 78.15 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.163 -179.471 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.517 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 0.7 OUTLIER -73.4 -22.59 60.21 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.003 0.43 . . . . 0.0 110.199 -179.246 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.22 -47.53 70.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.619 0.723 . . . . 0.0 111.348 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 63' ' ' TYR . 0.8 OUTLIER -56.77 -40.79 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.12 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.429 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 21.1 mtmt -67.86 -45.89 73.27 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.015 0.912 . . . . 0.0 111.127 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.66 -32.24 63.06 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.963 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.83 -14.28 79.9 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -97.83 -168.94 1.75 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.42 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.6 p -163.84 127.64 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.543 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -155.5 108.39 2.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.462 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -69.44 70.11 0.26 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.723 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -58.94 -101.03 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.64 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -163.44 149.13 11.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.568 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 52.66 98.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.626 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -65.61 138.13 57.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.572 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -60.02 -49.04 79.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.511 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -168.9 130.71 1.23 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.373 179.939 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mtt . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' SER . . . . . 0.437 ' O ' ' O ' ' B' ' 3' ' ' GLU . 15.4 p -165.48 -24.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.559 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' B' ' 5' ' ' PHE . 80.6 mm-40 56.52 158.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.489 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 57.2 mt 56.76 6.89 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.633 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' PHE . . . . . 0.45 ' H ' ' C ' ' B' ' 3' ' ' GLU . 54.1 p90 -70.06 -34.45 73.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.344 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -78.35 132.32 37.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.312 0.577 . . . . 0.0 109.793 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.589 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.2 t -67.01 -39.86 24.95 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.135 178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.589 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 76.7 Cg_exo -50.42 -26.75 16.82 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.89 1.727 . . . . 0.0 112.154 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.6 -40.76 92.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.426 0.631 . . . . 0.0 110.517 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.76 -41.78 87.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.487 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 56.2 mt -67.44 -44.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 CA-C-O 121.292 0.568 . . . . 0.0 110.267 -179.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -49.18 -27.67 3.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.59 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 61.6 t-20 -74.23 -35.11 63.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.593 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -57.29 -40.17 77.22 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.09 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -65.8 -35.91 82.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.282 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' HIS . . . . . 0.439 ' O ' ' OD1' ' B' ' 21' ' ' ASN . 7.5 m-70 -65.96 -48.74 70.32 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.561 -0.455 . . . . 0.0 110.742 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -74.77 -33.12 30.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.0 110.694 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.19 -56.61 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.073 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' MET . . . . . 0.436 ' C ' ' ND2' ' B' ' 21' ' ' ASN . 47.6 mtt -87.28 -56.27 3.44 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.998 0.428 . . . . 0.0 110.617 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' B' ' 17' ' ' HIS . 3.7 m-80 73.58 46.19 0.22 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.026 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -39.95 -64.54 0.48 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.127 0.489 . . . . 0.0 111.02 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -140.62 3.44 1.88 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.768 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -86.99 -131.85 0.06 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.125 0.488 . . . . 0.0 110.335 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -156.43 -158.13 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.336 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -95.47 -101.87 0.16 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.514 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' ILE . . . . . 0.401 HD11 ' OE1' ' B' ' 70' ' ' GLU . 44.3 mm -62.64 -37.26 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.43 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -69.89 2.55 3.34 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.536 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -50.36 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.038 0.447 . . . . 0.0 111.087 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.562 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.11 -42.61 99.4 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.995 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.562 ' N ' ' SD ' ' B' ' 30' ' ' MET . 13.8 t-20 -50.6 -51.52 47.76 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.523 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 70.3 p -63.63 -51.56 64.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.591 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 43.2 t80 -65.09 -20.4 66.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' TYR . . . . . 0.675 ' O ' HG23 ' B' ' 38' ' ' VAL . 52.9 t80 -72.97 -53.87 10.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.062 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' CZ ' ' A' ' 34' ' ' TYR . 19.7 mmm180 -72.51 -18.32 61.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.821 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.0 t -68.92 -51.64 37.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.947 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' VAL . . . . . 0.527 HG23 ' N ' ' B' ' 38' ' ' VAL . 10.2 m -77.4 -44.72 30.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.675 HG23 ' O ' ' B' ' 34' ' ' TYR . 71.0 t -53.71 -49.45 57.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.382 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 36.8 t -64.44 -25.74 68.14 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.864 0.364 . . . . 0.0 110.348 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' THR . . . . . 0.546 ' O ' ' N ' ' B' ' 44' ' ' ASP . 35.5 m -83.13 -50.52 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.554 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.561 HD22 ' CZ ' ' B' ' 55' ' ' ARG . 96.8 mt -63.02 -42.24 99.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.921 0.391 . . . . 0.0 110.827 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.5 t -68.47 -17.7 22.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.415 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -108.0 -19.25 13.57 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.048 0.451 . . . . 0.0 110.794 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' B' ' 40' ' ' THR . 37.6 t70 -90.5 -25.54 20.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.394 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -117.62 160.56 21.08 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.308 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -168.74 31.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.9 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 69.1 m -67.09 -41.19 86.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 110.902 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.487 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -174.08 142.93 0.88 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.265 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 56.6 m-20 -51.49 -34.85 37.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.741 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ALA . . . . . 0.487 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -75.51 -50.97 14.08 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.858 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -50.67 -43.23 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.698 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' VAL . . . . . 0.422 HG23 ' N ' ' B' ' 53' ' ' LEU . 23.0 m -75.15 -38.01 41.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.07 0.462 . . . . 0.0 110.285 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' LEU . . . . . 0.422 ' N ' HG23 ' B' ' 52' ' ' VAL . 65.7 tp -57.97 -36.27 72.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.573 -179.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' LYS . . . . . 0.417 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 57.6 mtpt -57.33 -41.57 80.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.549 -179.294 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' ARG . . . . . 0.561 ' CZ ' HD22 ' B' ' 41' ' ' LEU . 67.6 mtp180 -65.63 -41.36 92.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.117 0.484 . . . . 0.0 110.449 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 21.9 mm -65.33 -50.5 72.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.856 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -57.53 -39.42 76.56 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.311 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 52.8 m170 -65.85 -44.97 83.86 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.161 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.7 tp -53.57 -27.78 28.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.099 0.476 . . . . 0.0 111.016 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -52.52 -36.7 55.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.94 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.78 -31.66 71.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.477 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.98 -58.88 4.09 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.124 0.488 . . . . 0.0 110.813 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -40.19 61.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.353 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -66.66 -39.06 88.03 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.595 0.712 . . . . 0.0 110.319 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.7 mmtp -62.67 -36.8 84.06 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.305 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.4 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 82.2 t -63.8 -42.15 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-O 121.378 0.608 . . . . 0.0 110.264 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -67.18 -45.12 77.92 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.693 0.759 . . . . 0.0 111.488 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 51.7 ttt85 -88.71 1.49 55.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.103 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -108.67 -34.37 2.65 Favored Glycine 0 N--CA 1.474 1.226 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.473 ' HG3' ' H ' ' B' ' 71' ' ' SER . 1.5 pp20? -66.93 -55.41 14.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.549 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 71' ' ' SER . . . . . 0.473 ' H ' ' HG3' ' B' ' 70' ' ' GLU . 93.0 p 43.09 -165.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.621 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -146.51 -17.64 0.43 Allowed 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.427 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 4.3 tt -84.36 127.35 33.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.219 0.533 . . . . 0.0 110.529 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -118.01 -114.49 0.33 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.553 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 75' ' ' HIS . . . . . 0.575 ' NE2' ' NE2' ' B' ' 76' ' ' HIS . 79.4 t60 -155.49 -109.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.404 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' HIS . . . . . 0.575 ' NE2' ' NE2' ' B' ' 75' ' ' HIS . 6.2 m-70 -85.46 142.68 29.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.154 0.502 . . . . 0.0 110.406 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -59.38 -77.47 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.453 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 53.05 177.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.551 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -64.25 -45.46 88.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 14.9 p80 . . . . . 0 C--O 1.222 -0.393 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.451 -179.978 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 N-CA-C 110.217 -0.29 . . . . 0.0 110.217 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -67.52 -41.63 32.46 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.943 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 59.1 Cg_exo -49.58 -24.84 9.96 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 C-N-CA 121.727 1.618 . . . . 0.0 111.915 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.59 -40.92 89.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.022 0.439 . . . . 0.0 110.362 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.6 m-85 -59.31 -42.38 91.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.232 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -65.88 -43.93 92.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.025 0.441 . . . . 0.0 110.421 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -50.84 -29.74 12.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.55 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -69.87 -35.73 74.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 110.57 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.431 HD21 ' CD1' ' A' ' 33' ' ' TYR . 42.2 mt -67.36 -38.53 84.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.693 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -55.91 -36.22 67.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -69.4 -36.69 76.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.5 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -60.88 -50.86 71.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 19' ' ' GLU . 14.1 pt -72.07 -43.65 66.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.155 0.502 . . . . 0.0 110.942 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 18' ' ' ILE . 50.5 tp10 -66.53 -51.74 53.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.391 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.1 mtt -104.51 -157.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 0.0 109.856 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' SER . 61.4 t30 -142.77 62.58 1.4 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.455 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 23' ' ' SER . 6.1 tp-100 -73.01 39.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.528 0.68 . . . . 0.0 110.87 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' ASN . 5.0 p 75.76 50.86 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.402 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 12.6 tp10 -143.62 -137.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.718 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -151.78 -164.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.373 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -84.25 -105.42 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.467 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.435 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.3 mt -62.21 -41.79 92.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -57.61 -6.03 0.44 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.457 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -61.2 -45.12 95.89 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.185 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.6 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -63.42 -45.46 90.85 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.216 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.587 ' N ' ' SD ' ' A' ' 30' ' ' MET . 55.4 t30 -53.47 -49.72 66.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.047 -0.661 . . . . 0.0 110.65 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 77.0 p -63.33 -50.39 70.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.03 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.431 ' CD1' HD21 ' A' ' 14' ' ' LEU . 48.2 t80 -69.33 -22.07 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.746 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 30' ' ' MET . 40.2 t80 -74.81 -56.65 4.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.304 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -60.22 -25.25 65.48 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 120.984 0.421 . . . . 0.0 110.325 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.8 t -72.31 -45.99 57.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.865 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -66.68 -63.03 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.494 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.486 HG23 ' N ' ' A' ' 39' ' ' SER . 20.0 m -46.33 -40.49 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.523 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.486 ' N ' HG23 ' A' ' 38' ' ' VAL . 37.6 m -59.2 -39.64 83.29 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.2 m -74.42 -44.56 51.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.572 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.446 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 91.0 mt -56.51 -22.93 36.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.604 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.8 t -92.32 -28.34 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.594 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -90.37 -38.33 13.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.39 0.614 . . . . 0.0 110.813 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.451 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 26.2 p-10 -42.55 -59.4 1.9 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.986 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.438 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 13.3 pt20 -167.76 124.21 1.1 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.557 0.694 . . . . 0.0 110.395 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mp -94.7 51.72 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.378 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t -60.37 -31.33 70.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.221 0.534 . . . . 0.0 110.374 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -169.65 128.1 0.94 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.0 p30 -49.31 -33.3 12.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.179 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -71.93 -49.37 38.23 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.785 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.1 t -46.9 -38.68 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.37 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.21 -34.56 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.267 0.556 . . . . 0.0 111.099 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.457 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.82 -46.46 87.84 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.026 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -40.44 94.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.008 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.445 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 75.3 mtp180 -65.98 -39.79 90.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.283 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 86.6 mt -66.27 -46.24 87.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -58.1 -34.95 70.74 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -69.82 -42.21 73.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.16 -29.49 45.71 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.549 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -52.62 -29.91 28.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.543 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -63.45 -32.95 74.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.142 0.496 . . . . 0.0 110.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.41 -58.1 4.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.765 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.529 ' OH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -52.02 -43.41 63.69 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 110.071 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -64.29 -33.73 76.49 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.386 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -64.2 -39.22 93.53 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.575 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.25 -51.33 72.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.394 0.616 . . . . 0.0 110.435 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -65.32 -45.97 82.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.842 0.829 . . . . 0.0 111.333 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -54.42 -25.42 24.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.127 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.12 -12.72 82.96 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 0.0 110.408 179.906 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.45 -0.46 0 CA-C-O 120.948 0.404 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.621 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 74.4 t -57.49 -49.72 92.23 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.971 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 8.7 Cg_endo -47.44 -23.81 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.349 1.366 . . . . 0.0 112.279 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -63.62 -42.56 98.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.089 0.471 . . . . 0.0 110.651 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.423 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.71 -43.91 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.366 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 67.5 mt -69.18 -44.01 81.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.2 0.524 . . . . 0.0 110.569 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -50.72 -26.78 5.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.337 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -72.67 -31.79 65.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.893 0.378 . . . . 0.0 110.278 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.98 -36.17 69.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.529 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -55.82 -39.37 71.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.989 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -65.64 -36.39 83.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -62.84 -51.41 67.14 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.635 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.6 pt -73.02 -43.2 59.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.087 0.47 . . . . 0.0 110.811 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -64.97 -55.2 20.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.687 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 42.7 mtt -98.05 -145.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 p30 -170.63 46.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.153 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.01 -44.72 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.554 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 m -179.97 69.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.148 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -165.08 -134.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.32 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -156.94 -167.44 2.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.346 0.593 . . . . 0.0 110.014 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -83.23 -106.07 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.585 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.461 ' C ' ' H ' ' B' ' 29' ' ' ALA . 21.3 tt -63.0 -34.57 67.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -67.59 8.09 0.4 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.779 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.48 -45.25 39.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.679 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.419 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -60.9 -46.67 89.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.834 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.79 -46.14 67.49 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.516 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -67.56 -54.17 22.21 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.835 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.423 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -61.76 -46.17 90.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.252 0.548 . . . . 0.0 110.669 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.601 ' O ' HG23 ' B' ' 38' ' ' VAL . 68.5 t80 -55.98 -47.11 78.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.741 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.529 ' NH2' ' OH ' ' A' ' 63' ' ' TYR . 76.0 ttt180 -66.16 -34.22 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -62.33 -45.01 95.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 110.649 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 85.5 t -69.26 -44.87 80.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.501 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.601 HG23 ' O ' ' B' ' 34' ' ' TYR . 65.5 t -51.25 -48.19 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.434 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 78.4 p -56.39 -43.05 78.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.473 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . 0.43 ' O ' ' N ' ' B' ' 44' ' ' ASP . 95.8 m -64.38 -44.62 90.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.674 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 93.1 mt -60.85 -47.29 87.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.508 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.11 -40.84 86.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 110.369 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.483 ' O ' ' C ' ' B' ' 44' ' ' ASP . 94.8 mt-30 -72.97 -32.39 65.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.151 0.5 . . . . 0.0 110.655 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 43' ' ' GLN . 67.0 t0 -28.5 -84.2 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.147 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.51 ' O ' ' N ' ' B' ' 47' ' ' THR . 26.5 pt20 -162.78 9.76 0.06 Allowed 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.47 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' B' ' 45' ' ' GLN . 1.1 tt 26.03 42.0 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.031 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.51 ' N ' ' O ' ' B' ' 45' ' ' GLN . 5.2 t -60.05 -33.01 71.47 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.447 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -154.32 127.43 8.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.592 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -47.45 -33.53 6.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.9 -50.22 57.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.2 t -50.79 -46.46 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.318 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -76.22 -39.93 35.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.378 0.608 . . . . 0.0 111.406 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -66.56 -40.56 89.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.896 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.405 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 17.8 mtpp -58.18 -44.87 88.24 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.172 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -65.62 -34.94 79.39 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.977 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.2 mm -69.08 -48.19 70.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.419 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -59.58 -43.5 93.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.128 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 64.9 m-70 -69.86 -45.48 67.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.441 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.404 HD23 ' CE1' ' B' ' 34' ' ' TYR . 51.2 tp -51.57 -28.68 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.03 -29.37 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.394 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.02 -35.5 73.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.61 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.04 -49.39 37.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.773 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -55.48 -42.06 73.84 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.524 HD21 ' NH2' ' B' ' 68' ' ' ARG . 48.3 t30 -68.56 -36.84 79.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.281 0.562 . . . . 0.0 110.854 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -60.33 -41.37 93.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.46 -47.85 79.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.67 0.748 . . . . 0.0 110.608 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -44.61 94.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.926 0.87 . . . . 0.0 111.381 -179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.524 ' NH2' HD21 ' B' ' 64' ' ' ASN . 42.6 ttm180 -63.74 -21.14 66.26 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.964 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.48 -20.21 14.0 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 . . . . . 0 N--CA 1.469 0.497 0 CA-C-O 120.666 0.269 . . . . 0.0 110.613 -179.688 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.506 0 CA-C-O 120.956 0.408 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.602 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.6 t -67.31 -39.3 19.77 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.051 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 60.7 Cg_exo -53.08 -25.97 30.88 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 121.834 1.689 . . . . 0.0 111.951 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -60.18 -43.19 96.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 0.0 110.422 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.3 m-85 -57.08 -40.46 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.08 -44.2 84.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.09 0.472 . . . . 0.0 110.352 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -51.13 -30.75 17.41 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.614 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -69.08 -32.07 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.501 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.21 -38.63 66.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.4 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -56.09 -34.01 65.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.105 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -67.77 -33.42 74.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.402 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -65.35 -51.42 60.63 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.785 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.16 -40.07 65.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.321 0.581 . . . . 0.0 110.782 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -67.83 -53.78 24.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.136 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.419 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 44.7 mtt -98.74 -65.0 0.99 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.091 0.472 . . . . 0.0 110.086 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 21.0 t30 80.99 47.91 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.878 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -53.27 -40.76 64.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.299 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.2 p -158.87 64.91 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -161.89 -132.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.334 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 64.5 m-20 -158.66 -172.03 3.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.36 0.6 . . . . 0.0 110.062 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -77.73 -104.62 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.593 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.555 ' C ' ' H ' ' A' ' 29' ' ' ALA . 16.2 tt -63.97 -36.02 75.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.046 0.451 . . . . 0.0 110.768 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -68.05 16.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.92 -44.99 21.46 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.246 0.546 . . . . 0.0 110.263 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.647 ' O ' ' N ' ' A' ' 34' ' ' TYR . 26.3 tpp -61.9 -48.59 79.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.957 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.495 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 62.6 t-20 -47.28 -53.23 14.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.724 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.1 m -62.1 -50.31 72.43 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.959 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 40.8 t80 -67.2 -21.97 65.75 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.647 ' N ' ' O ' ' A' ' 30' ' ' MET . 45.2 t80 -73.91 -60.33 2.31 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.342 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -61.16 -26.33 67.62 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.922 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -66.23 -47.89 72.33 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.708 0.289 . . . . 0.0 110.491 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.6 -48.06 60.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.422 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.455 HG21 ' CE1' ' A' ' 34' ' ' TYR . 99.2 t -62.46 -53.96 40.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.716 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 m -59.7 -18.39 42.02 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.36 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.0 m -87.51 -49.32 7.27 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.102 0.477 . . . . 0.0 111.078 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' CD1' ' HE ' ' A' ' 55' ' ' ARG . 96.6 mt -70.81 -42.85 69.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.66 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 42' ' ' VAL . 43.4 t -78.3 27.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.401 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 41' ' ' LEU . 74.6 mt-30 -147.61 2.92 0.73 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.729 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 46' ' ' LEU . 38.5 t70 -150.37 168.09 25.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.133 0.492 . . . . 0.0 110.278 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.9 tt0 67.31 -64.86 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.504 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.1 mt 36.96 43.34 0.29 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.332 0.587 . . . . 0.0 111.183 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 t -76.53 -31.85 57.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.425 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -170.82 131.32 0.84 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.645 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -50.07 -37.69 34.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.626 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.87 -48.46 71.47 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.315 0.578 . . . . 0.0 110.555 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -53.39 -44.02 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.628 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.12 -36.63 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-O 121.012 0.434 . . . . 0.0 111.09 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.22 -47.66 83.45 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.71 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 15.5 pttp -50.2 -38.44 40.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.206 0.527 . . . . 0.0 110.21 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.428 ' HE ' ' CD1' ' A' ' 41' ' ' LEU . 15.2 mmm180 -64.55 -38.4 90.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.173 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.01 -51.12 73.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.302 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.426 HE22 HG11 ' B' ' 42' ' ' VAL . 97.1 mm-40 -53.58 -45.29 69.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.367 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.404 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 2.2 m80 -65.08 -38.28 90.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -54.54 -30.43 53.93 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.172 -178.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -61.41 -32.1 72.04 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.036 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -59.31 -40.46 86.32 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.199 0.524 . . . . 0.0 110.844 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.63 -49.27 33.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.237 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -49.75 -43.1 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.944 -179.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.572 ' ND2' ' NE ' ' A' ' 68' ' ' ARG . 1.7 t-20 -66.95 -35.84 80.87 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.333 0.587 . . . . 0.0 110.372 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 30.7 tptt -69.61 -41.43 75.72 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.507 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -46.19 96.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 122.12 0.962 . . . . 0.0 110.664 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' HD3' HD11 ' A' ' 27' ' ' ILE . 26.7 mmtm -66.84 -43.11 84.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.449 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.572 ' NE ' ' ND2' ' A' ' 64' ' ' ASN . 78.0 mtm180 -81.51 -15.14 55.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.454 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -92.88 -37.76 5.66 Favored Glycine 0 N--CA 1.471 1.012 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.447 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.7 pp20? . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.055 0.455 . . . . 0.0 110.378 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.231 0.113 0 N-CA-C 110.295 -0.261 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.503 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -56.44 -45.49 99.92 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.197 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 88.5 Cg_exo -45.78 -23.52 1.64 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.533 1.489 . . . . 0.0 112.615 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.91 -39.96 91.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.354 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -60.36 -42.35 95.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.347 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.33 -45.3 98.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.056 0.455 . . . . 0.0 110.437 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -48.61 -28.38 3.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.577 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -74.37 -39.76 62.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.6 mt -69.49 -46.22 67.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.329 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -62.79 -26.06 68.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.459 0.647 . . . . 0.0 110.519 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -63.45 -29.63 70.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.569 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.573 ' NE2' ' O ' ' B' ' 25' ' ' ASP . 82.8 t60 -81.84 -61.56 1.88 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.258 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.418 ' H ' HG23 ' B' ' 18' ' ' ILE . 2.7 pt -50.5 -37.25 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-O 121.385 0.612 . . . . 0.0 110.359 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -74.14 -55.5 6.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.662 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -101.52 -119.76 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.055 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.448 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 21.2 p-10 -176.42 74.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.258 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -79.89 -72.34 0.41 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.221 0.534 . . . . 0.0 110.245 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 28.5 p -172.99 85.19 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.359 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . 0.441 ' N ' ' CE1' ' B' ' 17' ' ' HIS . 9.4 tp10 -169.73 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.562 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . 0.573 ' O ' ' NE2' ' B' ' 17' ' ' HIS . 91.7 m-20 -135.36 -95.9 0.25 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.741 0.305 . . . . 0.0 110.339 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -163.13 -99.51 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.178 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.93 -40.59 89.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.131 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -71.18 -14.53 62.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.462 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.21 -40.4 5.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.76 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.558 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -66.17 -48.36 70.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.495 ' ND2' ' OD1' ' A' ' 31' ' ' ASN . 39.8 t-20 -57.1 -48.53 78.39 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.694 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 41.1 t -62.51 -44.72 95.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.347 0.594 . . . . 0.0 111.014 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -73.96 -46.75 42.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.869 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.809 ' O ' HG23 ' B' ' 38' ' ' VAL . 50.5 t80 -49.15 -40.46 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.891 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.521 ' NH2' ' CG ' ' A' ' 34' ' ' TYR . 42.7 ttm180 -72.57 -30.22 64.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.088 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 12.5 t -61.56 -43.19 99.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.537 HG12 HD23 ' B' ' 41' ' ' LEU . 87.3 t -73.19 -43.73 56.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 110.577 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.809 HG23 ' O ' ' B' ' 34' ' ' TYR . 88.6 t -54.71 -45.99 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.585 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 42.2 t -58.83 -41.62 87.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.381 . . . . 0.0 110.402 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 31.5 m -72.32 -46.03 57.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.207 0.527 . . . . 0.0 110.775 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.537 HD23 HG12 ' B' ' 37' ' ' VAL . 0.6 OUTLIER -53.33 -30.5 39.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.534 -179.451 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.426 HG11 HE22 ' A' ' 57' ' ' GLN . 87.9 t -90.71 -28.4 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.306 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -73.86 -22.4 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.48 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' B' ' 41' ' ' LEU . 44.9 p30 -79.99 -176.06 5.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.302 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -43.26 141.58 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.688 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -122.9 61.63 1.01 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.24 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.441 HG22 ' H ' ' B' ' 47' ' ' THR . 0.9 OUTLIER -63.45 -31.54 72.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.936 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -168.08 126.84 1.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.848 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.491 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 23.4 p30 -46.87 -28.46 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.491 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -73.59 -51.25 17.52 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.289 0.566 . . . . 0.0 110.555 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.9 t -49.22 -44.94 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.657 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.0 m -73.4 -35.71 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-O 121.193 0.521 . . . . 0.0 110.742 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.53 -27.97 68.18 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.537 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.485 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 55.8 mttp -53.84 -44.44 70.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.987 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.48 ' HD2' HD11 ' B' ' 41' ' ' LEU . 44.2 mtt180 -68.65 -38.89 80.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.483 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.426 HD12 HG22 ' B' ' 38' ' ' VAL . 32.0 mm -63.33 -52.61 56.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.298 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -57.35 -37.69 72.98 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.485 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 27.6 m-70 -74.82 -44.29 50.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.514 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 31.9 tp -55.35 -29.67 58.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.239 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.406 ' OD1' ' OH ' ' B' ' 34' ' ' TYR . 87.9 m-20 -51.58 -38.76 55.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.333 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.75 -30.34 32.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.463 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.44 -54.02 14.05 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.487 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -50.05 -39.07 40.81 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.268 0.556 . . . . 0.0 110.074 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.483 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 50.2 t30 -72.66 -38.83 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . 0.418 ' CE ' HH21 ' B' ' 68' ' ' ARG . 46.5 mmtt -61.66 -39.57 91.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.343 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.1 t -60.3 -50.16 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.15 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 17.8 mtmt -72.72 -49.88 28.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.54 0.686 . . . . 0.0 111.661 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.418 HH21 ' CE ' ' B' ' 65' ' ' LYS . 68.8 ttp85 -57.14 -32.22 66.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.86 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.65 -12.72 84.21 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 . . . . . 0 N--CA 1.468 0.467 0 CA-C-O 120.91 0.386 . . . . 0.0 110.559 -179.871 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.534 0.329 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.51 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -61.24 -43.75 91.09 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.6 Cg_exo -49.59 -27.46 14.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 121.104 1.203 . . . . 0.0 112.267 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.26 -42.45 99.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.527 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -58.61 -44.1 89.81 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 48.3 mt -67.44 -43.71 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.243 0.544 . . . . 0.0 110.595 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -51.94 -33.38 37.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.499 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -67.37 -32.06 72.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.077 0.465 . . . . 0.0 110.4 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.8 mt -71.41 -38.72 71.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.626 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -53.77 -34.37 58.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.046 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -66.8 -36.65 82.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.491 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -61.6 -51.91 66.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.652 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.42 -43.57 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.866 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -65.79 -51.87 55.43 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.472 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 34.9 mtt -104.5 -160.68 0.78 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.151 0.501 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -154.54 51.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.276 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -59.3 -50.56 73.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.962 0.41 . . . . 0.0 110.38 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 p -177.15 71.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.45 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -167.87 -132.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.307 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -155.44 -166.42 2.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.038 0.447 . . . . 0.0 110.406 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.92 -104.27 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.609 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.8 tt -63.41 -39.28 84.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 52.0 t-80 -63.39 10.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.159 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.542 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -76.93 -44.43 31.58 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.003 0.43 . . . . 0.0 110.638 178.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -62.86 -46.64 86.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.012 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' OD1' ' NH2' ' B' ' 35' ' ' ARG . 44.5 t30 -53.58 -48.97 68.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.641 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.4 p -64.77 -54.06 37.24 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.906 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -61.03 -42.72 99.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.316 0.579 . . . . 0.0 110.384 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.416 ' CB ' ' O ' ' A' ' 30' ' ' MET . 44.3 t80 -55.45 -48.06 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -75.56 -20.43 58.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.3 . . . . 0.0 110.471 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.9 t -68.22 -50.8 51.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.489 HG23 ' N ' ' A' ' 38' ' ' VAL . 4.7 m -74.82 -45.94 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.489 ' N ' HG23 ' A' ' 37' ' ' VAL . 55.2 t -56.45 -48.27 80.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.824 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -61.23 -42.26 98.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.4 m -69.31 -46.81 66.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.801 0.334 . . . . 0.0 110.743 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.627 HD22 HH11 ' A' ' 55' ' ' ARG . 82.5 mt -62.66 -30.37 71.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.37 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 38' ' ' VAL . 74.7 t -85.32 -38.01 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.599 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.49 -6.44 19.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.252 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.473 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 54.5 p30 -149.05 165.86 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.901 0.381 . . . . 0.0 110.506 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.484 HE22 ' NH2' ' A' ' 55' ' ' ARG . 51.0 tt0 82.78 -73.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.499 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt 43.52 42.28 3.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.119 0.485 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.8 m -62.27 -37.8 86.85 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.433 0.635 . . . . 0.0 110.227 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 57.9 tttp -178.6 145.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.516 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -57.43 -40.65 78.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.662 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.52 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -66.36 -47.74 72.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.021 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.0 t -53.58 -65.21 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.229 -178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.7 -32.14 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.955 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -41.15 96.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.883 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.402 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 25.1 mtpp -59.67 -41.98 91.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.098 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.627 HH11 HD22 ' A' ' 41' ' ' LEU . 94.0 mtt180 -65.18 -41.83 94.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.056 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.7 -51.55 49.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.429 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.438 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 15.4 mm100 -56.95 -41.19 77.85 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 19.2 m-70 -71.06 -41.88 70.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.689 0.28 . . . . 0.0 110.364 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.47 -22.56 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.598 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 4.3 p-10 -57.41 -30.49 64.98 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.486 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.5 pt-20 -60.7 -33.64 73.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 0.0 110.257 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.11 -57.46 4.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.883 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.98 -39.21 25.71 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.45 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 52.4 t30 -70.87 -39.95 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.931 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -60.66 -46.82 88.86 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 84.3 t -54.83 -55.07 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.163 -0.615 . . . . 0.0 110.326 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HD2' HD11 ' A' ' 27' ' ' ILE . 16.1 mtmt -60.35 -46.22 90.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.177 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.0 tpt85 -58.25 -14.06 6.41 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.719 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.88 9.1 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 . . . . . 0 C--N 1.329 -0.32 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.85 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 C--O 1.231 0.107 0 N-CA-C 110.353 -0.24 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.1 t -72.43 -38.48 5.34 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-O 119.306 -0.378 . . . . 0.0 109.992 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 59.6 Cg_exo -53.48 -28.61 45.5 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.379 1.386 . . . . 0.0 111.806 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -60.64 -44.46 96.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.68 0.276 . . . . 0.0 110.352 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.46 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.1 m-85 -58.18 -37.53 74.93 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.147 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.68 -47.1 72.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.37 -25.91 6.87 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.525 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -70.31 -31.42 68.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.373 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.69 -39.74 66.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.685 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -32.83 68.09 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.041 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.426 ' CD ' ' NE2' ' B' ' 22' ' ' GLN . 48.3 tt0 -66.37 -30.65 71.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.573 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -69.16 -51.98 32.74 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.712 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 pt -72.81 -44.44 58.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 121.044 0.45 . . . . 0.0 110.709 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.71 -53.02 57.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.693 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.9 mmt -96.29 -147.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 109.874 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -171.21 45.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.013 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.426 ' NE2' ' CD ' ' B' ' 16' ' ' GLN . 50.2 mt-30 -54.85 -46.12 74.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.659 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t 178.52 68.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.445 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . 0.415 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 16.9 tp10 -160.9 -130.99 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.399 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -160.37 -171.81 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.362 0.601 . . . . 0.0 110.369 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -78.44 -106.45 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.132 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.488 ' C ' ' H ' ' B' ' 29' ' ' ALA . 20.0 tt -64.83 -32.79 59.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.615 0.245 . . . . 0.0 110.691 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.09 7.78 0.26 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.608 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.07 -43.0 36.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.267 0.556 . . . . 0.0 110.575 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.476 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 16.2 ptt? -59.45 -47.1 86.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.355 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.476 ' N ' ' CG ' ' B' ' 30' ' ' MET . 33.6 m120 -54.14 -43.41 70.51 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.501 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.415 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 78.3 p -70.65 -55.43 8.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.727 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.46 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 42.2 t80 -59.59 -46.15 89.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.216 0.531 . . . . 0.0 110.598 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.418 ' CB ' ' O ' ' B' ' 30' ' ' MET . 59.4 t80 -55.77 -48.55 75.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.004 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.476 ' NH2' ' OD1' ' A' ' 31' ' ' ASN . 44.5 ttm180 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.393 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.5 t -70.04 -50.99 35.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.896 0.379 . . . . 0.0 110.488 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.0 t -68.18 -56.73 11.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.5 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 69.1 t -48.44 -49.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.328 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 71.3 m -57.81 -36.41 72.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.3 m -71.21 -49.99 37.73 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.949 0.404 . . . . 0.0 111.309 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.3 mt -53.23 -36.62 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.294 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.1 -38.63 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.411 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -115.93 78.16 1.16 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.407 0.622 . . . . 0.0 110.237 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -178.38 -69.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.765 0.793 . . . . 0.0 110.716 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 67.8 tp60 -86.34 -74.89 0.4 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.54 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tt 69.28 43.67 1.04 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.165 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -80.75 -27.69 36.73 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.334 0.587 . . . . 0.0 110.524 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -178.7 145.81 0.32 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 50' ' ' ALA . 18.3 p-10 -64.26 -45.03 89.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.56 -39.93 85.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.832 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 12.6 t -57.93 -62.11 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.845 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -54.19 -33.81 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.574 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.72 -60.63 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.689 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.456 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 16.8 ptpt -58.23 -35.59 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.929 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -62.91 -35.72 81.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.078 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 88.4 mt -71.23 -46.2 66.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.492 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -54.75 -25.37 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.14 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.456 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 50.8 m170 -70.2 -44.97 67.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.211 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.408 HD13 ' HB3' ' B' ' 62' ' ' ALA . 0.5 OUTLIER -51.61 -20.98 2.25 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.591 -179.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -59.46 -45.31 91.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.178 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.14 -37.68 88.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.065 0.46 . . . . 0.0 110.654 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . 0.408 ' HB3' HD13 ' B' ' 59' ' ' LEU . . . -72.36 -53.89 11.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.913 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.03 -37.71 21.57 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.101 0.476 . . . . 0.0 109.773 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -65.6 -37.21 85.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.652 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 15.5 tptp -55.34 -39.57 70.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.717 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.24 -39.27 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-O 121.836 0.827 . . . . 0.0 110.515 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -64.91 -46.85 79.95 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.803 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -86.05 -12.24 50.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.336 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -92.57 -37.15 5.91 Favored Glycine 0 N--CA 1.476 1.364 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.012 0.434 . . . . 0.0 110.207 -179.879 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.688 0.28 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.464 ' CG1' ' NE2' ' A' ' 58' ' ' HIS . 1.0 OUTLIER -58.52 -46.52 99.6 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.748 179.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 99.1 Cg_exo -40.66 -29.78 0.46 Allowed 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 121.248 1.299 . . . . 0.0 112.764 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -59.15 -48.36 81.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.183 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -47.15 85.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.763 0.316 . . . . 0.0 110.26 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.9 mt -61.14 -47.44 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 121.324 0.583 . . . . 0.0 110.41 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -46.27 -32.55 3.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.745 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -60.85 -35.75 77.36 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.2 mp -76.52 -40.06 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.782 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -62.59 -35.43 79.5 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.867 0.365 . . . . 0.0 110.256 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.48 -29.94 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.584 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -72.68 -56.04 5.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.462 HG22 ' HA ' ' A' ' 26' ' ' LYS . 2.1 pt -67.38 -42.33 87.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.335 0.588 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.8 tt0 -62.24 -53.42 55.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.639 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.3 mtt -98.58 -132.4 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -170.35 50.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.449 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -58.1 -50.58 72.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.596 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.0 p -174.19 21.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -134.9 175.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.368 1.08 . . . . 0.0 109.806 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -112.23 -126.5 0.28 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.364 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HA ' HG22 ' A' ' 18' ' ' ILE . 99.4 mttt -113.42 -87.93 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.663 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.4 mm -68.12 -24.17 29.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.683 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -84.67 -9.7 58.0 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.376 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 -51.23 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.828 0.347 . . . . 0.0 110.496 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.556 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -64.14 -41.06 97.35 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.556 ' N ' ' SD ' ' A' ' 30' ' ' MET . 50.3 t30 -56.62 -51.78 67.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.354 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.9 t -65.27 -51.36 61.3 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.773 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -60.71 -53.55 56.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.46 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.428 ' N ' ' O ' ' A' ' 30' ' ' MET . 38.3 t80 -54.84 -48.75 72.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.903 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.3 tpt180 -60.28 -40.03 88.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.918 0.389 . . . . 0.0 110.183 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.1 m -64.8 -41.14 96.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.0 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.23 -60.44 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.63 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 39' ' ' SER . 8.3 p -52.15 -43.42 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.252 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.502 ' N ' HG13 ' A' ' 38' ' ' VAL . 69.6 m -62.53 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -57.94 -43.99 86.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.375 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.21 -45.63 62.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.259 0.552 . . . . 0.0 110.631 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.691 HG12 ' O ' ' A' ' 42' ' ' VAL . 61.0 t -82.33 26.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.29 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -159.98 19.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.319 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -168.77 21.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.231 . . . . 0.0 110.467 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -172.3 62.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.488 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 30.8 mt -100.66 50.52 0.88 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.369 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.2 t -72.31 -34.68 68.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.385 0.612 . . . . 0.0 110.436 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -163.92 132.07 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.439 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 19.4 p30 -48.59 -36.63 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.605 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.439 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -69.18 -53.24 21.05 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 111.03 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.6 t -48.24 -44.31 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.564 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -75.8 -40.16 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.985 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 14.2 mt -59.34 -40.5 86.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.548 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -52.82 -50.2 64.14 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.531 -0.467 . . . . 0.0 109.921 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -62.38 -43.16 99.49 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.259 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.5 mt -64.01 -55.64 20.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.638 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -50.92 -41.26 58.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.167 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.464 ' NE2' ' CG1' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -73.05 -43.45 61.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.902 179.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 41.3 tp -56.89 -29.63 63.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.782 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -52.79 -52.56 56.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.246 -0.582 . . . . 0.0 110.377 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -51.39 -29.49 15.81 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.758 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -66.34 -62.26 1.57 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.764 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -43.36 64.69 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -61.61 -25.77 67.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.25 -179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.559 ' NZ ' ' NH2' ' A' ' 68' ' ' ARG . 31.2 tptt -75.1 -32.74 61.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.622 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.5 t -67.21 -52.4 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-O 121.367 0.604 . . . . 0.0 110.465 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -47.17 79.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.84 0.828 . . . . 0.0 111.6 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.559 ' NH2' ' NZ ' ' A' ' 65' ' ' LYS . 70.7 ttp85 -57.17 -24.74 56.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.981 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -84.22 -16.21 67.5 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 . . . . . 0 CA--C 1.516 -0.363 0 CA-C-O 121.167 0.508 . . . . 0.0 110.492 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.463 0.181 0 CA-C-O 120.722 0.296 . . . . 0.0 110.321 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.507 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.4 t -60.58 -41.98 85.86 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.662 -0.685 . . . . 0.0 109.837 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.507 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 79.9 Cg_exo -47.21 -34.27 17.61 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 121.123 1.215 . . . . 0.0 112.223 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -55.45 -41.95 73.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.183 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -44.83 95.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.383 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.414 ' O ' ' N ' ' B' ' 14' ' ' LEU . 30.5 mt -60.61 -48.29 89.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.456 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -45.31 -32.4 1.99 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.66 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -59.14 -35.31 73.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.639 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.0 mp -73.19 -38.22 66.22 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.775 0.321 . . . . 0.0 110.307 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.95 -34.41 77.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.043 0.449 . . . . 0.0 110.315 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -64.51 -28.85 69.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.626 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -72.18 -53.63 12.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.858 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.447 HD12 ' OE1' ' B' ' 70' ' ' GLU . 6.2 pt -70.63 -43.04 77.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.313 0.577 . . . . 0.0 110.729 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.09 -39.55 82.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.204 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -126.0 -135.26 0.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.907 0.385 . . . . 0.0 110.552 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -173.3 55.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.268 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -60.07 -44.82 94.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.285 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t 175.33 71.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -166.25 -124.76 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.798 0.332 . . . . 0.0 110.393 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -156.94 -168.71 2.73 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.312 0.577 . . . . 0.0 110.006 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -89.8 -98.63 0.1 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.37 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.1 mm -61.5 -44.42 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.811 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -57.58 -8.35 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.582 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.66 -48.34 75.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.532 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.427 ' O ' ' N ' ' B' ' 34' ' ' TYR . 2.3 ptm -67.15 -50.31 61.71 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.457 ' OD1' ' NH1' ' A' ' 35' ' ' ARG . 91.5 m-20 -56.89 -44.76 82.62 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.508 -179.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -69.96 -51.23 34.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.805 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.523 ' CE1' HD11 ' B' ' 14' ' ' LEU . 44.5 t80 -63.63 -51.65 64.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.827 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.769 ' O ' HG23 ' B' ' 38' ' ' VAL . 57.0 t80 -52.66 -44.44 66.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.022 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -69.33 -36.7 77.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.573 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 45.1 m -60.55 -39.12 86.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.407 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.74 -54.97 13.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.32 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.769 HG23 ' O ' ' B' ' 34' ' ' TYR . 49.1 t -48.49 -38.21 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.501 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.403 ' O ' ' CB ' ' B' ' 43' ' ' GLN . 77.6 p -64.95 -47.11 78.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.087 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -65.57 -46.12 80.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.445 0.641 . . . . 0.0 111.234 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -62.9 -34.99 78.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.651 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 79.2 t -85.59 -37.99 12.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 39' ' ' SER . 47.8 tt0 -75.93 -0.5 21.66 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.661 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' B' ' 41' ' ' LEU . 46.6 m-20 -157.13 171.54 20.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 52.24 42.36 30.77 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.578 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.98 43.63 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.422 HG23 ' N ' ' B' ' 48' ' ' LYS . 4.6 t -65.4 -43.21 91.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.446 0.641 . . . . 0.0 110.557 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' B' ' 50' ' ' ALA . 28.7 tptp -158.22 131.47 7.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.643 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -46.54 -42.78 16.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.267 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.437 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -62.28 -50.84 70.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.934 179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 28.5 t -51.0 -46.85 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.451 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.424 ' O ' HG12 ' B' ' 56' ' ' ILE . 29.3 m -76.3 -45.09 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 121.594 0.711 . . . . 0.0 111.146 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.417 ' N ' HG23 ' B' ' 52' ' ' VAL . 60.9 tp -56.84 -42.69 80.11 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.606 -178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -53.48 -45.33 69.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.184 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -40.13 90.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.424 HG12 ' O ' ' B' ' 52' ' ' VAL . 26.2 mm -65.43 -52.3 53.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.445 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -52.7 -47.25 67.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.185 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -67.09 -44.88 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.283 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.6 tp -52.17 -27.49 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.319 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -52.16 -45.11 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.348 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -50.07 -28.45 7.16 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.708 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.87 -63.49 1.05 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.705 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -47.47 -46.35 26.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.38 0.609 . . . . 0.0 110.083 -179.74 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.469 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.2 t-20 -59.22 -36.75 75.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.055 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.1 tptp -60.81 -34.29 74.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.439 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 60.0 t -69.92 -51.24 41.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.523 0.678 . . . . 0.0 110.497 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' B' ' 69' ' ' GLY . 5.4 mmmt -72.92 -21.75 60.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.564 1.173 . . . . 0.0 112.359 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -38.54 -27.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.685 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' B' ' 67' ' ' LYS . . . 155.27 66.67 0.01 OUTLIER Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' B' ' 18' ' ' ILE . 60.3 mm-40 . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.453 -0.317 0 CA-C-O 120.762 0.315 . . . . 0.0 110.351 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.547 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 4.3 t -67.13 -42.4 40.43 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.107 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 68.2 Cg_exo -49.23 -24.37 8.12 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 121.529 1.486 . . . . 0.0 112.125 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -70.14 -41.29 74.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.183 0.516 . . . . 0.0 110.449 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.414 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -62.81 -47.29 84.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.274 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.11 -42.97 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.342 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -49.27 -25.15 2.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.717 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -75.63 -38.03 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.077 0.465 . . . . 0.0 110.599 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 43.6 mt -63.71 -39.33 94.03 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.548 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -55.32 -36.74 66.54 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.236 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.6 tt0 -65.77 -32.42 73.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.517 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.69 -52.28 46.49 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.806 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 8.3 pt -73.96 -45.94 47.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.848 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 11.6 tm-20 -66.84 -50.37 62.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.426 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 4.1 tpp -94.79 -165.11 1.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.696 0.76 . . . . 0.0 109.934 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -154.56 44.11 0.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.257 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -56.98 -53.36 58.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.177 0.513 . . . . 0.0 110.286 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -174.73 70.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.385 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.71 -135.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.964 0.411 . . . . 0.0 110.204 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -156.57 -165.93 2.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.46 0.648 . . . . 0.0 109.928 -179.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.489 ' HZ3' HG12 ' A' ' 27' ' ' ILE . 17.9 ttpp -85.0 -103.23 0.05 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.451 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.532 ' C ' ' H ' ' A' ' 29' ' ' ALA . 3.3 mm -63.02 -38.99 83.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -64.54 8.34 0.12 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.804 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.46 -48.47 22.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.458 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.527 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.45 -43.94 96.33 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.277 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' ' SD ' ' A' ' 30' ' ' MET . 13.5 m120 -52.42 -46.18 66.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.323 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -70.74 -54.88 10.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.806 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.414 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 44.5 t80 -58.88 -49.26 78.43 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.243 0.544 . . . . 0.0 110.669 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.794 ' O ' HG23 ' A' ' 38' ' ' VAL . 72.0 t80 -58.07 -48.47 80.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.904 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -66.74 -36.27 82.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.958 0.409 . . . . 0.0 110.41 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -62.77 -44.2 96.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.634 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -71.55 -51.83 30.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.374 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 34' ' ' TYR . 88.3 t -51.19 -48.81 31.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.246 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -60.45 -39.61 88.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.2 m -65.7 -48.19 72.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.271 0.557 . . . . 0.0 110.863 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 44' ' ' ASP . 99.1 mt -56.91 -33.36 66.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.758 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -87.34 -38.47 12.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.309 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -53.17 -12.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.664 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.447 ' O ' ' O ' ' A' ' 41' ' ' LEU . 3.4 m-20 -173.01 -172.88 0.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.178 0.513 . . . . 0.0 110.003 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 58.04 33.22 22.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.96 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.63 44.33 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.452 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -64.31 -29.65 70.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.587 . . . . 0.0 110.702 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 87.8 tttt -168.22 131.3 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.713 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.661 HD22 ' N ' ' A' ' 50' ' ' ALA . 0.4 OUTLIER -48.42 -38.22 19.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.524 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.661 ' N ' HD22 ' A' ' 49' ' ' ASN . . . -67.05 -49.06 66.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.803 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -51.83 -45.11 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.374 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.481 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.4 m -77.79 -43.72 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.835 0.826 . . . . 0.0 111.116 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.433 ' N ' HG23 ' A' ' 52' ' ' VAL . 5.4 tt -63.69 -41.73 98.1 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.264 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -53.11 -40.01 63.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.987 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.435 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 53.1 mtp180 -67.51 -35.45 79.14 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 52' ' ' VAL . 40.9 mm -65.05 -51.11 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.58 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.598 ' NE2' HG11 ' B' ' 42' ' ' VAL . 98.1 mm-40 -57.65 -39.35 76.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.435 ' ND1' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -72.81 -46.37 53.49 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.089 0.471 . . . . 0.0 110.167 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.431 ' N ' ' CG ' ' A' ' 58' ' ' HIS . 29.5 tp -55.71 -25.02 38.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.631 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.39 -34.92 73.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.987 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.28 -32.24 72.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.955 0.407 . . . . 0.0 110.477 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.98 -54.27 13.99 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.81 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -46.71 69.21 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.966 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -62.49 -34.5 76.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.266 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -63.12 -37.85 88.87 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.404 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.8 t -57.86 -53.64 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.197 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -64.69 -44.27 90.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.746 0.784 . . . . 0.0 111.4 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -53.87 -27.86 32.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.019 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -86.09 -15.05 65.6 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 121.106 0.479 . . . . 0.0 110.229 -179.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . 0.456 ' O ' ' HB3' ' B' ' 9' ' ' TYR . 8.4 p . . . . . 0 CA--C 1.53 0.177 0 CA-C-O 118.8 -0.619 . . . . 0.0 110.448 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.491 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.8 t -35.77 -54.66 1.31 Allowed Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.701 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 12.6 Cg_endo -51.42 -21.59 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 121.305 1.337 . . . . 0.0 112.331 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 6' ' ' SER . 16.8 t80 -64.98 -47.54 77.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.338 0.589 . . . . 0.0 110.713 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.9 OUTLIER -72.95 -47.54 44.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.359 -179.472 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.5 mt -58.79 -42.15 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.159 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -47.42 -26.03 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.665 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . 0.431 ' ND2' ' NE2' ' B' ' 17' ' ' HIS . 54.3 t30 -74.08 -43.64 56.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.508 . . . . 0.0 110.464 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.96 -36.42 77.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.896 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . 0.45 ' NZ ' ' OE1' ' B' ' 19' ' ' GLU . 26.3 ttpp -58.78 -46.81 86.67 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.01 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.56 -29.05 69.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.578 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.431 ' NE2' ' ND2' ' B' ' 13' ' ' ASN . 5.7 m-70 -68.19 -52.7 31.47 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.686 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.403 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.4 pt -74.78 -46.2 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.014 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . 0.45 ' OE1' ' NZ ' ' B' ' 15' ' ' LYS . 82.7 tt0 -56.0 -54.66 42.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.553 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 45.7 mtt -97.87 -137.53 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.866 0.365 . . . . 0.0 110.039 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -171.38 43.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.305 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -55.99 -47.84 76.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.3 p -173.9 68.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.318 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -166.9 -137.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.927 0.394 . . . . 0.0 110.422 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -156.27 -156.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.397 0.618 . . . . 0.0 109.891 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.403 ' O ' HG22 ' B' ' 18' ' ' ILE . 1.7 ttmp? -93.81 -103.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.978 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.462 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.1 mm -62.18 -39.36 83.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -67.77 7.56 0.49 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.653 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.462 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.75 -48.39 22.0 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.05 0.453 . . . . 0.0 110.651 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.631 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -64.68 -46.05 84.03 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.298 179.51 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.555 ' N ' ' SD ' ' B' ' 30' ' ' MET . 26.0 t-20 -51.18 -52.86 40.22 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.064 -0.655 . . . . 0.0 110.912 -178.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 10.8 t -60.64 -46.84 88.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.791 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 47.1 t80 -72.79 -20.03 61.24 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.623 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.631 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.0 t80 -73.79 -55.43 6.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.289 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.37 -26.59 68.08 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.415 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 82.8 p -66.57 -46.56 75.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.35 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 55.8 t -70.18 -49.63 53.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.149 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.49 -49.28 84.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.361 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -65.5 -17.86 64.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 110.633 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -87.32 -52.02 5.62 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.84 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 43' ' ' GLN . 97.8 mt -66.99 -40.92 87.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.609 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.662 ' O ' HG12 ' B' ' 42' ' ' VAL . 61.7 t -77.89 18.4 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.048 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 41' ' ' LEU . 75.6 mt-30 -145.13 -1.45 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.727 0.299 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -114.2 -30.61 6.58 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.491 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -152.24 86.83 1.3 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.936 0.398 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.13 40.08 1.74 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.506 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -62.81 -17.94 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 110.401 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.682 ' O ' HG22 ' B' ' 51' ' ' VAL . 16.9 tptm -168.19 122.72 0.94 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.184 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -54.43 -15.98 2.01 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.049 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.436 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -80.31 -59.62 2.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.012 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.682 HG22 ' O ' ' B' ' 48' ' ' LYS . 23.1 m -45.93 -36.74 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.58 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.429 ' N ' HG23 ' B' ' 51' ' ' VAL . 32.7 m -77.53 -31.95 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.724 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' B' ' 50' ' ' ALA . 50.1 tp -58.05 -37.91 75.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.948 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.466 ' C ' ' HE ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -58.89 -45.48 90.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.386 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.564 ' HE ' ' N ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -64.3 -44.23 92.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.777 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.38 -51.54 69.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.581 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -56.52 -44.45 80.8 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 47.1 m170 -68.3 -42.09 79.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 tp -52.15 -26.03 10.39 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.741 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.39 -30.13 66.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -61.43 -36.75 81.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.889 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.43 -58.88 3.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -44.22 61.45 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.026 0.441 . . . . 0.0 110.014 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.62 -40.92 98.49 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.306 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 57.2 tttm -66.96 -35.32 79.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.173 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.66 -49.99 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.446 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.27 69.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.798 0.809 . . . . 0.0 111.582 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -63.84 -37.52 87.68 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.027 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.55 -26.9 72.2 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 . . . . . 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.612 -179.624 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 CA--C 1.533 0.309 0 CA-C-O 120.77 0.319 . . . . 0.0 110.466 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.58 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.5 t -51.69 -54.2 42.41 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 7.9 Cg_endo -46.99 -16.65 0.32 Allowed 'Trans proline' 0 C--N 1.306 -1.698 0 C-N-CA 122.045 1.83 . . . . 0.0 112.099 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -70.65 -47.13 61.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.114 0.483 . . . . 0.0 110.691 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.431 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.0 m-85 -62.97 -42.51 99.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.465 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 93.9 mt -65.43 -43.62 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.467 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -51.37 -26.27 7.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.436 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -72.95 -36.63 67.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.123 0.487 . . . . 0.0 110.597 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.41 -38.88 85.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.452 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.34 -37.0 74.27 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.105 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' MET . 59.2 tt0 -65.71 -30.27 70.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.651 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -68.63 -52.75 27.98 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.68 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.54 -44.59 53.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 0.0 110.965 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -67.79 -39.45 84.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.216 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.412 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 6.0 ttm -111.66 -163.21 0.84 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.529 0.68 . . . . 0.0 110.247 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -156.79 46.29 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.267 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -58.2 -49.46 76.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.176 0.512 . . . . 0.0 110.387 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -176.21 69.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -165.45 -133.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.272 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -157.0 -165.38 1.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.246 0.546 . . . . 0.0 110.124 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -81.37 -108.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.258 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.558 HD13 ' OE2' ' A' ' 70' ' ' GLU . 5.8 tp -63.87 -35.71 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -63.53 5.83 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.577 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.1 -43.15 54.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.5 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -62.6 -44.27 96.73 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' A' ' 30' ' ' MET . 29.9 m120 -52.49 -54.8 27.63 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.648 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.0 m -62.05 -55.25 31.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.431 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 55.1 t80 -57.23 -41.0 78.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.187 0.518 . . . . 0.0 110.596 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.43 ' O ' HG22 ' A' ' 38' ' ' VAL . 26.2 t80 -63.67 -52.37 60.99 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.989 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.526 HH12 ' CE ' ' B' ' 30' ' ' MET . 82.4 mtp180 -65.86 -27.14 68.01 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.2 p -72.0 -44.25 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.74 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.1 t -66.87 -63.11 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.763 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 39' ' ' SER . 22.8 m -49.13 -45.84 17.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.338 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.563 ' N ' HG23 ' A' ' 38' ' ' VAL . 64.7 p -58.42 -43.62 88.76 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.202 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.485 ' O ' ' N ' ' A' ' 44' ' ' ASP . 97.0 m -65.49 -46.84 78.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 110.65 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.534 HD22 HH11 ' A' ' 55' ' ' ARG . 88.5 mt -63.65 -43.49 96.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.579 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 42' ' ' VAL . 32.1 t -85.7 29.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.357 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.408 ' H ' ' H ' ' A' ' 44' ' ' ASP . 61.1 tp60 -160.68 -14.27 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.7 0.286 . . . . 0.0 110.796 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' THR . 31.4 t70 -114.37 -34.4 5.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.415 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -96.08 -79.59 0.44 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.543 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.4 mt 52.49 43.27 31.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.977 0.418 . . . . 0.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -88.65 -26.42 21.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.519 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -172.51 134.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.904 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 91.6 m-20 -54.72 -41.32 70.19 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.47 87.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.016 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.08 -43.59 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.523 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 56' ' ' ILE . 34.1 m -76.5 -36.85 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.406 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -59.94 -54.74 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.857 -177.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -38.71 92.01 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.428 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.534 HH11 HD22 ' A' ' 41' ' ' LEU . 42.3 ttm180 -65.49 -42.1 92.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.496 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 52' ' ' VAL . 71.3 mt -65.47 -45.79 91.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.497 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -54.63 -36.5 64.59 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.439 ' ND1' ' OE2' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -66.47 -35.53 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.619 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -62.35 -40.24 95.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.522 -177.329 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -50.21 -29.88 10.36 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE2' ' ND1' ' A' ' 58' ' ' HIS . 4.9 pt-20 -60.34 -34.4 73.79 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.418 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.74 -49.26 26.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.954 0.407 . . . . 0.0 110.738 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.86 -38.44 64.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.909 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -69.32 -36.86 77.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.62 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -60.19 -39.27 85.92 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.227 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.83 -47.32 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 122.041 0.924 . . . . 0.0 110.414 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -61.46 -41.42 97.2 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.47 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 55.9 ttt85 -67.53 -14.21 62.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.108 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.59 -63.01 1.12 Allowed Glycine 0 N--CA 1.461 0.363 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.558 ' OE2' HD13 ' A' ' 27' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 120.506 0.193 . . . . 0.0 110.742 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.559 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.4 OUTLIER -64.93 -42.53 63.18 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 70.9 Cg_exo -51.95 -22.25 13.88 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 121.896 1.73 . . . . 0.0 111.984 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -61.91 -42.39 99.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.437 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -64.4 -38.12 89.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.192 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.9 mt -64.23 -44.88 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -49.89 -22.54 1.54 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.573 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -69.7 -40.03 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.328 0.585 . . . . 0.0 110.553 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.04 -36.11 66.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -58.11 -32.83 68.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' B' ' 20' ' ' MET . 57.4 tt0 -75.13 -30.05 60.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.457 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -67.09 -51.44 54.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 0.0 110.661 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.431 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.5 pt -69.93 -41.82 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.497 0.665 . . . . 0.0 110.757 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -73.68 -51.72 15.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.661 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.453 ' HG3' HE21 ' B' ' 22' ' ' GLN . 9.0 tpp -90.2 -66.57 0.91 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.11 0.481 . . . . 0.0 110.583 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 t30 76.71 43.07 0.14 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.797 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' B' ' 20' ' ' MET . 90.8 mm-40 -55.25 -35.95 65.53 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.332 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 90.8 p -163.45 63.57 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.651 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -161.15 -132.82 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.39 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -153.21 -170.31 3.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.342 0.591 . . . . 0.0 110.316 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.431 ' O ' HG22 ' B' ' 18' ' ' ILE . 59.7 tttp -80.96 -108.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.442 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.658 HD11 ' HD2' ' B' ' 67' ' ' LYS . 21.0 tt -62.22 -38.47 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.34 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . 0.414 ' N ' HG23 ' B' ' 27' ' ' ILE . 80.7 m80 -58.48 -12.44 3.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.541 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.12 -41.62 49.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.522 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.545 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -65.38 -51.52 59.82 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.251 179.083 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.537 ' N ' ' SD ' ' B' ' 30' ' ' MET . 42.4 t30 -53.33 -37.28 62.16 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.243 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . 79.5 p -76.73 -52.36 9.74 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.026 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.437 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 85.0 t80 -65.84 -38.16 88.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.398 0.618 . . . . 0.0 110.921 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.545 ' N ' ' O ' ' B' ' 30' ' ' MET . 58.6 t80 -62.08 -56.63 16.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.423 -179.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 32' ' ' SER . 36.9 ptt180 -60.47 -25.52 66.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.16 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.19 -45.88 53.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.726 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -67.45 -64.76 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.362 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 39' ' ' SER . 19.4 m -45.41 -41.32 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.474 -179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.502 ' N ' HG23 ' B' ' 38' ' ' VAL . 14.0 t -60.26 -42.08 94.58 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -67.27 -46.12 74.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.797 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.4 mm? -59.84 -37.0 78.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.215 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.1 t -80.77 -38.14 16.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.365 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.38 -11.69 7.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.431 ' O ' ' O ' ' B' ' 41' ' ' LEU . 79.2 m-20 -143.55 161.79 37.55 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 121.318 0.58 . . . . 0.0 110.229 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 47.9 tt0 73.47 162.19 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.997 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 178.26 25.02 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -63.02 -32.07 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.113 0.482 . . . . 0.0 110.404 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -170.67 123.73 0.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.786 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.648 HD22 ' N ' ' B' ' 50' ' ' ALA . 0.5 OUTLIER -47.26 -29.71 2.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.437 179.447 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.648 ' N ' HD22 ' B' ' 49' ' ' ASN . . . -73.8 -47.04 41.6 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.19 0.519 . . . . 0.0 110.694 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.1 t -50.22 -42.68 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.304 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.3 m -76.14 -33.47 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.11 -40.85 98.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.43 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 36.8 pttt -53.0 -39.01 62.79 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -66.53 -40.75 89.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.132 -179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.72 -50.94 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.297 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . 0.437 ' NE2' HG11 ' A' ' 42' ' ' VAL . 95.4 mm-40 -57.88 -39.21 77.28 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.43 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 6.1 m-70 -74.03 -38.13 64.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.109 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 tp -56.07 -30.59 62.2 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.582 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.468 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 91.9 m-20 -52.47 -28.5 20.5 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.495 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -62.1 -35.27 78.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.799 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.01 -53.29 13.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.688 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -45.82 72.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.018 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 75.6 m-20 -63.45 -36.27 83.18 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.002 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . 0.412 ' HD2' HH21 ' B' ' 68' ' ' ARG . 34.5 tptt -61.37 -37.8 84.68 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.56 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.9 t -60.5 -58.22 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.284 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.658 ' HD2' HD11 ' B' ' 27' ' ' ILE . 16.4 mtmt -62.13 -47.04 86.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.66 0.743 . . . . 0.0 111.636 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.412 HH21 ' HD2' ' B' ' 65' ' ' LYS . 55.5 ttp180 -56.03 -15.89 4.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.08 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.81 -16.33 36.55 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 . . . . . 0 N--CA 1.467 0.391 0 CA-C-O 120.656 0.265 . . . . 0.0 110.54 -179.853 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 30.7 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 110.561 -0.163 . . . . 0.0 110.561 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.48 ' N ' ' OG ' ' A' ' 6' ' ' SER . 3.0 t -58.79 -55.17 48.88 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-O 118.814 -0.612 . . . . 0.0 109.787 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 71.6 Cg_exo -34.04 -31.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.843 0 C-N-CA 121.633 1.555 . . . . 0.0 113.092 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 7' ' ' VAL . 53.3 t80 -63.65 -43.97 95.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.589 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.4 m-85 -61.59 -43.16 99.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.143 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -64.91 -49.01 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.418 0.628 . . . . 0.0 110.668 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -50.69 -25.11 3.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.401 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -73.65 -38.37 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.03 0.443 . . . . 0.0 110.258 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 44.5 mt -63.26 -39.43 94.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.435 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -59.89 -39.61 85.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.101 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -59.08 -26.8 64.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.531 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -73.97 -52.71 11.95 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.113 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -74.18 -43.66 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.222 0.534 . . . . 0.0 110.706 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 67.5 mm-40 -67.33 -48.18 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.355 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 5.8 ttm -96.79 -161.03 0.84 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.373 0.606 . . . . 0.0 109.939 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -157.46 36.68 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.238 -179.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -53.22 -66.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.997 0.427 . . . . 0.0 110.437 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.1 m -163.59 69.6 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.521 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -159.94 -137.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.49 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -154.97 -168.67 2.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.262 0.553 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -81.21 -105.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.335 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.519 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.6 tt -65.29 -35.93 76.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.455 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 49.3 t-80 -65.44 8.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.749 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -74.43 -43.88 54.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.59 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.3 -44.5 94.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.286 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.59 ' N ' ' SD ' ' A' ' 30' ' ' MET . 42.4 t30 -52.05 -51.34 58.16 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.955 -0.698 . . . . 0.0 110.676 -178.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.0 t -65.16 -54.18 33.67 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.068 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 54.1 t80 -59.29 -43.64 92.54 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.322 0.582 . . . . 0.0 110.729 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.738 ' CE1' HG21 ' A' ' 38' ' ' VAL . 34.4 t80 -59.57 -56.79 17.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.175 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.608 ' NH2' ' CE2' ' B' ' 63' ' ' TYR . 72.8 ttt-85 -61.17 -28.34 69.06 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.166 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 69.2 m -68.69 -44.71 73.4 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.428 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.4 t -70.89 -55.71 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.285 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.738 HG21 ' CE1' ' A' ' 34' ' ' TYR . 98.1 t -52.93 -45.93 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.382 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.2 m -64.82 -21.86 66.87 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.383 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -86.29 -49.85 7.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.342 0.591 . . . . 0.0 111.018 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.485 HD22 ' NH1' ' A' ' 55' ' ' ARG . 86.5 mt -66.17 -43.58 86.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 42' ' ' VAL . 40.8 t -81.04 24.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.52 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -140.53 1.06 1.71 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.445 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 46' ' ' LEU . 44.9 t0 -146.97 167.33 24.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.318 0.58 . . . . 0.0 110.266 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 65.96 -64.4 0.2 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.55 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 44' ' ' ASP . 18.9 mt 37.66 50.19 1.14 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.193 0.52 . . . . 0.0 111.05 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -78.28 -30.45 48.49 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.694 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 88.2 tttt -174.2 132.76 0.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.365 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.712 ' H ' HD22 ' A' ' 49' ' ' ASN . 0.8 OUTLIER -50.26 -41.17 49.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.375 0.607 . . . . 0.0 110.833 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.424 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -62.83 -47.58 82.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.683 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 48.2 t -58.56 -47.42 88.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.269 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.0 t -67.89 -42.48 85.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.36 0.6 . . . . 0.0 110.627 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.9 tp -60.17 -43.14 96.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.399 -178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.77 -38.04 60.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.172 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.485 ' NH1' HD22 ' A' ' 41' ' ' LEU . 60.4 mtp180 -67.44 -41.44 84.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.243 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.454 HD12 HG22 ' A' ' 38' ' ' VAL . 33.7 mm -62.96 -51.1 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.478 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -54.98 -43.84 73.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.673 0.273 . . . . 0.0 110.382 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -68.56 -35.25 77.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.249 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -57.19 -39.78 76.08 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.281 -179.027 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -51.19 -26.88 7.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.886 0.374 . . . . 0.0 110.387 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.41 -38.03 88.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.8 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -53.39 11.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.911 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.01 -42.21 48.81 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.42 0.628 . . . . 0.0 109.935 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -63.95 -30.67 71.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.216 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -63.69 -36.86 85.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.488 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 66.5 t -66.17 -43.92 91.8 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-O 121.933 0.873 . . . . 0.0 110.579 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -63.12 -44.95 94.18 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.109 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -72.14 -12.33 61.14 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.048 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -93.73 -33.28 7.14 Favored Glycine 0 N--CA 1.475 1.299 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? . . . . . 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 110.359 -179.576 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 CA--C 1.522 -0.103 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.533 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 38.3 t -65.8 -40.89 43.14 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.026 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 71.4 Cg_exo -50.23 -13.26 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 120.821 1.014 . . . . 0.0 112.198 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -73.11 -41.03 64.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 110.59 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -73.21 -46.72 48.81 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.542 -179.809 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.82 -45.86 97.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.647 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -50.19 -20.97 1.15 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.257 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -66.91 -36.53 82.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 0.0 110.519 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -74.18 -35.94 64.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.621 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.38 -40.54 68.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.44 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.3 tt0 -65.44 -35.29 80.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.253 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -63.19 -51.84 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.8 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.4 pt -73.83 -45.81 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.106 0.479 . . . . 0.0 110.747 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' B' ' 18' ' ' ILE . 10.7 tm-20 -67.09 -51.06 59.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.355 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.414 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.1 tpp -91.59 -156.28 0.45 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.5 0.667 . . . . 0.0 110.004 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -164.74 41.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.202 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -57.33 -39.34 75.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.592 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t 174.45 70.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.54 -136.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.44 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -157.16 -159.91 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 110.39 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.444 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 63.2 tttm -91.0 -104.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.291 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.483 ' C ' ' H ' ' B' ' 29' ' ' ALA . 39.0 mm -62.47 -41.37 91.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.287 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' B' ' 28' ' ' HIS . 61.4 t-80 -62.08 2.18 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.693 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.52 -46.53 54.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.61 0.243 . . . . 0.0 110.663 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.496 ' CE ' ' ND2' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -60.13 -42.64 95.26 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.174 179.494 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' CE ' ' B' ' 30' ' ' MET . 30.7 m120 -52.02 -50.84 60.6 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.788 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 72.1 m -66.52 -56.16 12.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.962 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 80.7 t80 -56.58 -46.23 80.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.053 0.454 . . . . 0.0 110.605 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.438 ' CB ' ' O ' ' B' ' 30' ' ' MET . 79.5 t80 -57.87 -47.32 83.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.986 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 74.7 ttt-85 -71.16 -24.88 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.337 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 36.4 p -72.59 -47.83 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.46 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.78 -56.95 9.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.591 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -48.98 -45.54 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 69.3 m -60.7 -34.82 74.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.771 0.319 . . . . 0.0 110.304 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.8 m -74.15 -47.84 33.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.196 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.5 -36.12 66.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.21 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -81.55 -31.79 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.294 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -124.12 82.73 2.06 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.549 0.69 . . . . 0.0 110.016 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -170.94 -67.03 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.944 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -102.06 -45.51 5.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.933 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 12.2 mt 44.04 60.82 2.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -92.84 -26.58 17.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.367 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.51 138.41 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.65 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -55.73 -43.1 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.162 0.506 . . . . 0.0 110.549 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.39 -43.06 97.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.92 -35.52 65.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.069 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 49.0 t -78.2 -44.44 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.425 0.631 . . . . 0.0 111.028 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.464 HD23 ' O ' ' B' ' 53' ' ' LEU . 1.1 tt -60.86 -51.99 66.97 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.857 -178.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptmm? -57.08 -39.88 75.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.264 0.554 . . . . 0.0 110.214 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.36 -37.88 88.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.336 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.8 mt -66.91 -46.53 84.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.37 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.87 -37.44 68.81 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.445 ' C ' ' ND1' ' B' ' 58' ' ' HIS . 1.4 t-80 -73.31 -37.35 66.2 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.67 ' O ' HD13 ' B' ' 59' ' ' LEU . 1.1 tm? -62.92 -39.96 96.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.78 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.403 ' O ' ' OD1' ' B' ' 64' ' ' ASN . 50.0 m-20 -50.43 -29.72 10.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.443 ' OE1' ' CD2' ' B' ' 58' ' ' HIS . 3.3 pt-20 -59.86 -33.07 71.31 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.669 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.24 -51.19 26.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.61 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.608 ' CE2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -53.34 -44.13 68.23 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.108 0.48 . . . . 0.0 109.766 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' B' ' 60' ' ' ASP . 22.6 m120 -64.48 -32.44 74.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.1 tptp -60.39 -37.01 79.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.587 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.78 -46.29 94.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.724 0.773 . . . . 0.0 110.318 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.15 -47.19 52.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 122.183 0.992 . . . . 0.0 111.901 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -60.51 -26.1 66.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.139 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.22 -63.7 1.57 Allowed Glycine 0 C--N 1.33 0.213 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? . . . . . 0 N--CA 1.452 -0.357 0 CA-C-O 120.719 0.295 . . . . 0.0 110.506 179.974 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.295 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.599 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 t -72.5 -38.18 5.02 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.13 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 41.0 Cg_exo -56.35 -22.35 41.08 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 121.565 1.51 . . . . 0.0 111.892 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -60.64 -48.15 83.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.828 0.347 . . . . 0.0 110.285 -179.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.75 -37.37 73.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.087 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -67.94 -44.11 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.006 0.431 . . . . 0.0 110.526 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -51.95 -26.41 10.39 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -72.16 -30.92 65.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.968 0.413 . . . . 0.0 110.21 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.458 HD21 ' CD2' ' A' ' 33' ' ' TYR . 50.3 mt -68.83 -38.89 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.701 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.32 -34.13 73.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.091 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -66.33 -29.36 69.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.595 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 47.6 m170 -71.43 -53.52 13.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.78 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.91 -39.45 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.755 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.28 -55.62 31.49 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.809 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.442 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 69.0 mtm -107.51 -62.77 1.38 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.952 0.406 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 8.2 t30 83.56 51.56 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.795 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -48.19 -41.93 28.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.513 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -160.83 65.87 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.593 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.428 ' C ' HD21 ' A' ' 21' ' ' ASN . 20.2 tp10 -158.72 -134.73 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.418 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 73.4 m-20 -148.14 -166.22 2.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.188 0.518 . . . . 0.0 110.363 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -86.09 -110.03 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.543 HD11 ' HD2' ' A' ' 67' ' ' LYS . 17.9 tt -61.29 -33.63 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 120.797 0.332 . . . . 0.0 110.351 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.644 ' CD2' HD22 ' A' ' 31' ' ' ASN . 46.4 t-80 -67.42 2.05 1.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.48 79.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.562 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.412 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -63.15 -43.86 97.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.89 179.82 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.644 HD22 ' CD2' ' A' ' 28' ' ' HIS . 43.8 t30 -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.609 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -66.2 -53.57 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.86 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.458 ' CD2' HD21 ' A' ' 14' ' ' LEU . 64.1 t80 -61.0 -46.34 91.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.614 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.433 ' CE2' HD23 ' A' ' 59' ' ' LEU . 33.8 t80 -58.77 -42.36 88.77 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.487 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -67.4 -31.21 71.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 0.0 110.199 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.9 t -70.94 -42.69 69.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.1 t -67.32 -61.22 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.479 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 39' ' ' SER . 11.8 p -47.94 -40.88 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.074 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 38' ' ' VAL . 58.6 m -54.0 -47.49 71.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 96.3 m -83.67 -32.49 25.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.664 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.2 tt -56.35 -45.01 80.61 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.149 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 42' ' ' VAL . 77.8 t -68.48 -4.92 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.189 0.518 . . . . 0.0 110.529 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -113.94 -39.89 3.86 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.802 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -46.83 -47.86 21.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.337 0.589 . . . . 0.0 110.097 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -103.15 -91.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.276 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 73.2 35.04 0.96 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.986 0.422 . . . . 0.0 110.191 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 t -98.24 -23.84 15.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.735 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -167.04 131.65 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.753 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -52.24 -34.72 47.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.285 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.03 -48.64 57.13 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.944 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -50.82 -42.75 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.693 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -76.28 -31.98 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.612 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.35 -47.56 83.66 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.673 -178.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' CE1' ' A' ' 58' ' ' HIS . 2.1 ptpp? -63.36 -40.92 98.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.393 0.616 . . . . 0.0 110.157 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.403 ' N ' ' HG3' ' A' ' 54' ' ' LYS . 16.1 tpp180 -65.29 -43.58 90.71 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.27 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.63 -44.47 99.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -55.09 -31.23 61.05 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.435 ' CE1' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -71.9 -36.5 70.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 18.6 tp -73.56 -29.09 62.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.471 ' O ' ' CD2' ' A' ' 63' ' ' TYR . 90.8 m-20 -52.53 -38.91 60.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.993 0.425 . . . . 0.0 110.322 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -66.84 -18.7 65.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.486 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -67.13 -61.69 1.8 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.019 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.605 ' CD1' ' NH2' ' B' ' 35' ' ' ARG . 1.0 OUTLIER -56.01 -40.41 73.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.884 0.85 . . . . 0.0 110.154 -179.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.468 ' N ' ' CG ' ' A' ' 63' ' ' TYR . 52.2 t30 -62.83 -40.27 96.9 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.468 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -58.16 -42.68 86.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.2 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.482 ' O ' ' N ' ' A' ' 70' ' ' GLU . 72.7 t -62.88 -55.65 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.207 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 27' ' ' ILE . 21.0 mtmt -63.15 -43.05 99.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.513 0.673 . . . . 0.0 111.336 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -66.79 -18.89 65.6 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.11 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 70' ' ' GLU . . . -107.86 -13.11 20.93 Favored Glycine 0 N--CA 1.464 0.554 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 66' ' ' VAL . 4.2 mm-40 . . . . . 0 N--CA 1.468 0.438 0 CA-C-O 121.183 0.516 . . . . 0.0 110.657 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 110.893 -0.04 . . . . 0.0 110.893 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 3.2 t -55.24 -54.97 44.62 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 118.903 -0.57 . . . . 0.0 109.808 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 52.3 Cg_exo -34.3 -27.5 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.009 0 C-N-CA 121.7 1.6 . . . . 0.0 113.124 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 7' ' ' VAL . 57.5 t80 -58.35 -37.77 75.84 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.304 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -61.78 -43.18 99.36 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.5 -46.95 82.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.84 0.828 . . . . 0.0 110.738 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -49.32 -23.14 1.29 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.63 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . 0.414 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 18.5 m120 -74.93 -36.09 62.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.517 0.675 . . . . 0.0 110.595 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' B' ' 14' ' ' LEU . 16.4 mt -69.13 -38.51 78.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.34 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -54.15 -39.98 67.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.165 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -70.71 -31.81 68.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.238 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.469 ' O ' ' ND2' ' B' ' 21' ' ' ASN . 43.2 m170 -66.74 -50.41 62.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.704 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.3 pt -72.93 -36.16 50.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.329 0.585 . . . . 0.0 110.656 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -77.39 -54.65 6.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.069 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 18.8 tpp -81.77 -58.65 2.9 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.257 0.551 . . . . 0.0 110.54 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 17' ' ' HIS . 3.1 m120 69.5 36.76 2.13 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.866 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -60.28 -38.65 84.23 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.276 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.1 m -152.22 60.07 0.84 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.742 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -166.7 -133.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.139 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -158.44 -168.58 2.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.407 0.623 . . . . 0.0 110.358 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -85.8 -104.23 0.06 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.277 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.454 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.4 mm -61.31 -37.34 77.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -64.42 3.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.882 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.454 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.78 -46.81 51.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.828 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.407 ' O ' ' CB ' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -62.5 -50.84 69.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.948 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -58.75 -48.04 82.57 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.447 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -65.34 -53.79 38.54 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.546 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 39.5 t80 -60.11 -53.14 61.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.078 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.414 ' O ' HG22 ' B' ' 38' ' ' VAL . 55.1 t80 -53.44 -42.06 66.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.605 ' NH2' ' CD1' ' A' ' 63' ' ' TYR . 73.0 ttt-85 -68.55 -35.17 77.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.2 t -64.6 -43.0 95.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.486 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.47 ' O ' ' N ' ' B' ' 41' ' ' LEU . 62.2 t -67.1 -65.35 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.594 HG23 ' N ' ' B' ' 39' ' ' SER . 29.9 m -47.64 -49.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.7 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.594 ' N ' HG23 ' B' ' 38' ' ' VAL . 34.2 p -47.48 -61.09 2.09 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 119.994 -0.682 . . . . 0.0 111.401 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -74.62 -44.18 51.84 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.273 1.035 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.47 ' N ' ' O ' ' B' ' 37' ' ' VAL . 51.3 tp -57.31 -34.44 68.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.579 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 38' ' ' VAL . 53.6 t -75.65 -2.28 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.9 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -155.58 41.04 0.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.401 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -99.12 -59.45 1.72 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.101 0.477 . . . . 0.0 110.389 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -113.19 -31.97 6.45 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.528 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 tt 48.79 68.02 0.77 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.257 0.551 . . . . 0.0 110.163 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.2 t -96.49 -25.34 15.69 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.298 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -180.0 140.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.688 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -61.97 -44.77 96.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.76 86.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 9.0 t -57.93 -62.04 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.704 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 25.5 m -54.03 -33.82 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.434 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -61.72 2.21 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.048 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.32 -34.67 64.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.206 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -65.34 -39.57 92.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 86.5 mt -67.65 -49.97 65.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.335 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -56.52 -38.28 71.63 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.479 ' CE1' ' OE1' ' B' ' 61' ' ' GLU . 34.0 t60 -69.78 -43.29 72.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.32 -27.5 47.49 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.488 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -53.29 -36.71 61.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.435 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.479 ' OE1' ' CE1' ' B' ' 58' ' ' HIS . 5.8 pt-20 -57.72 -31.27 66.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.387 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.43 -58.13 4.05 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.79 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.3 -40.71 49.37 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.032 0.444 . . . . 0.0 109.933 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -68.98 -36.62 78.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.578 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -65.05 -35.77 82.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.616 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 77.6 t -57.24 -52.92 50.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.09 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -69.69 -38.4 76.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.012 0.911 . . . . 0.0 111.664 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -40.85 -32.84 0.25 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.394 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.93 -44.76 5.91 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 121.056 0.455 . . . . 0.0 110.035 -179.486 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.585 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.9 t -65.84 -40.47 39.32 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.124 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 49.9 Cg_exo -54.19 -26.61 43.19 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 121.79 1.66 . . . . 0.0 112.066 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.19 -41.05 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.281 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.432 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.6 m-85 -60.38 -39.39 87.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.364 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.3 mt -67.79 -45.27 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.979 0.419 . . . . 0.0 110.461 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -48.2 -23.99 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.529 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -74.48 -33.79 62.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 110.685 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.58 -37.51 68.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.314 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -57.26 -41.08 79.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.993 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.562 HE21 HE21 ' A' ' 22' ' ' GLN . 56.4 tt0 -67.95 -31.29 70.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.543 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -66.17 -50.69 63.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.819 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 pt -70.92 -39.94 75.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.25 0.548 . . . . 0.0 110.83 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -57.59 -53.86 53.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.252 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 72.8 mtm -114.49 -118.82 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.404 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -171.67 61.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.377 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.562 HE21 HE21 ' A' ' 16' ' ' GLN . 8.1 tp-100 -73.41 50.35 0.31 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 122.105 0.955 . . . . 0.0 110.96 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 76.79 55.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.136 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -156.51 -134.68 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.21 0.528 . . . . 0.0 110.614 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -159.38 -169.29 2.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.21 -179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.7 tttm -80.71 -105.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.356 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.456 ' C ' ' H ' ' A' ' 29' ' ' ALA . 6.9 tt -65.71 -31.12 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.53 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -69.86 10.33 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.557 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.56 -45.18 22.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.358 0.599 . . . . 0.0 110.872 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.9 ptm -62.01 -50.76 70.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.401 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -53.61 -46.91 70.59 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.397 -178.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -67.05 -53.6 29.59 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.055 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.432 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 47.4 t80 -62.4 -49.63 74.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.385 0.612 . . . . 0.0 110.99 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.507 ' N ' ' O ' ' A' ' 30' ' ' MET . 75.9 t80 -54.56 -47.94 72.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.07 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -65.25 -38.1 89.29 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.4 p -59.89 -43.41 94.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.401 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 98.0 t -70.89 -49.55 49.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.468 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.6 -49.25 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.396 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.8 t -59.02 -35.92 74.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.817 0.341 . . . . 0.0 110.452 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 90.1 m -71.66 -49.77 36.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.412 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -49.74 -34.26 18.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -86.21 -33.48 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.5 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 44' ' ' ASP . 84.3 mt-30 -111.33 81.63 1.47 Allowed 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.989 0.9 . . . . 0.0 109.736 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.458 ' CB ' ' O ' ' A' ' 43' ' ' GLN . 3.6 t70 156.94 136.44 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.204 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.431 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 56.4 tt0 69.21 -62.23 0.41 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt 45.56 70.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.058 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -101.25 -28.9 12.39 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.302 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HE3' ' HB3' ' A' ' 50' ' ' ALA . 34.5 ttpt -178.17 144.83 0.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.232 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.91 -41.96 97.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' HE3' ' A' ' 48' ' ' LYS . . . -58.37 -46.18 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.982 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.4 -64.86 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.74 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 53' ' ' LEU . 31.9 m -53.8 -39.69 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.602 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.432 ' N ' HG23 ' A' ' 52' ' ' VAL . 57.4 tp -60.43 -52.27 65.94 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.733 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 49.5 mtpt -52.07 -37.02 52.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.568 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -66.48 -34.28 77.59 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.181 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.7 mt -71.81 -52.77 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.779 -0.369 . . . . 0.0 110.354 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.76 -32.98 69.77 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.141 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.4 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -77.12 -46.91 21.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.6 tp -52.23 -27.16 13.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.44 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -51.26 -38.35 52.21 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.397 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -54.71 -33.02 60.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.588 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.49 16.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.549 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.461 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.29 -44.81 68.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.141 0.496 . . . . 0.0 110.318 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -65.83 -35.56 81.02 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.961 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.32 -40.01 94.93 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.416 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.65 -48.81 86.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.455 0.645 . . . . 0.0 110.467 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -44.14 92.38 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.414 1.102 . . . . 0.0 111.698 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -55.77 -27.67 52.15 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.63 -8.5 84.58 Favored Glycine 0 CA--C 1.518 0.262 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 61.6 mm-40 . . . . . 0 N--CA 1.471 0.6 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 43.7 t . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 120.938 0.399 . . . . 0.0 110.739 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.486 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.7 t -57.4 -54.92 49.8 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.148 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 50.2 Cg_exo -35.06 -29.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.117 1.878 . . . . 0.0 113.081 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . 0.472 ' N ' ' O ' ' B' ' 7' ' ' VAL . 41.0 t80 -56.22 -41.85 76.3 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.018 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.403 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.8 m-85 -62.11 -40.23 95.18 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 36.3 mt -64.86 -48.78 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 121.295 0.569 . . . . 0.0 110.343 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.85 -26.49 35.71 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.311 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . 0.451 ' ND2' ' O ' ' B' ' 9' ' ' TYR . 4.5 m120 -69.49 -35.57 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.872 0.368 . . . . 0.0 110.235 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.516 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -68.3 -36.92 80.08 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.635 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -56.42 -32.54 64.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.033 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' B' ' 20' ' ' MET . 1.9 pt20 -67.25 -35.06 78.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.378 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -65.33 -50.74 64.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.505 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.8 pt -73.36 -41.73 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.564 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -72.07 -53.77 11.86 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.428 ' N ' ' O ' ' B' ' 16' ' ' GLN . 24.8 ttm -86.47 -69.06 0.7 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.106 0.479 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' B' ' 25' ' ' ASP . 43.2 t30 74.93 45.03 0.16 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.706 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -40.04 -34.35 0.28 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.461 0.648 . . . . 0.0 111.097 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.1 p -167.09 -20.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.659 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -61.42 -132.52 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.917 0.389 . . . . 0.0 110.593 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 69.1 m-20 -155.79 -166.29 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.351 0.596 . . . . 0.0 110.099 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.41 -101.81 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.793 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.7 mm -65.66 -39.69 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.186 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . 0.472 ' CD2' ' O ' ' B' ' 28' ' ' HIS . 73.2 t60 -65.64 11.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.278 . . . . 0.0 110.508 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.92 -49.25 18.35 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.938 0.399 . . . . 0.0 110.475 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.594 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -58.01 -39.93 79.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.258 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.565 ' N ' ' SD ' ' B' ' 30' ' ' MET . 93.2 m-20 -49.75 -40.4 40.91 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 22.3 t -80.12 -55.92 4.59 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.619 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.516 ' CD1' HD21 ' B' ' 14' ' ' LEU . 63.4 t80 -58.18 -46.6 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.085 0.469 . . . . 0.0 110.887 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.594 ' N ' ' O ' ' B' ' 30' ' ' MET . 28.9 t80 -57.22 -51.52 68.99 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.897 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 74.9 ttt180 -67.08 -25.94 66.48 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.7 m -70.9 -46.95 61.64 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.566 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' B' ' 40' ' ' THR . 77.8 t -64.95 -65.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.63 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.596 HG23 ' N ' ' B' ' 39' ' ' SER . 23.6 m -45.69 -46.23 4.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.537 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.596 ' N ' HG23 ' B' ' 38' ' ' VAL . 42.0 t -59.67 -26.58 65.66 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . 0.458 ' O ' ' N ' ' B' ' 44' ' ' ASP . 28.9 m -85.22 -51.12 6.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.779 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.88 -45.05 91.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.78 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 38' ' ' VAL . 69.7 t -58.23 -22.1 18.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.078 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -103.8 -26.79 12.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.577 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' B' ' 40' ' ' THR . 51.3 t0 -56.74 -47.4 80.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.207 0.527 . . . . 0.0 110.766 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -133.38 -167.09 1.87 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.313 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 179.1 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.578 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.438 HG22 ' H ' ' B' ' 47' ' ' THR . 0.0 OUTLIER -62.91 -45.49 92.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.264 0.554 . . . . 0.0 110.284 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -156.89 133.0 9.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -50.24 -25.3 3.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.617 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.612 ' C ' ' HZ2' ' B' ' 54' ' ' LYS . . . -78.16 -53.4 7.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.075 0.464 . . . . 0.0 110.948 179.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 23.3 t -46.04 -39.52 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.286 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -77.05 -32.01 19.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.25 0.547 . . . . 0.0 110.599 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 tp -59.95 -29.83 68.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.259 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.612 ' HZ2' ' C ' ' B' ' 50' ' ' ALA . 28.5 mmtm -62.03 -46.7 88.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.453 0.644 . . . . 0.0 110.525 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -64.95 -42.74 94.36 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.399 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 78.4 mt -62.8 -50.1 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.451 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -54.33 -35.76 63.04 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 8.9 m-70 -72.36 -22.3 61.17 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' B' ' 59' ' ' LEU . 0.2 OUTLIER -76.42 -23.97 53.98 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.347 179.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.4 -41.67 98.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.452 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' B' ' 58' ' ' HIS . 7.9 pt-20 -61.77 -31.47 71.67 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.947 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.93 -57.86 4.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.532 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -42.97 55.9 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 110.212 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -63.43 -33.72 76.17 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.765 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -64.4 -38.1 89.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.441 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.01 -48.33 89.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.464 0.65 . . . . 0.0 110.4 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -48.21 50.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.211 1.005 . . . . 0.0 111.692 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -59.46 -35.17 73.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.106 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.44 -16.56 75.68 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 121.047 0.451 . . . . 0.0 110.583 -179.893 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 N--CA 1.45 -0.43 0 CA-C-O 121.055 0.455 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.654 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 57.2 t -65.04 -48.25 71.36 Favored Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 9.0 Cg_endo -47.34 -23.64 3.35 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 121.636 1.557 . . . . 0.0 112.296 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -62.32 -43.69 98.24 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.04 0.448 . . . . 0.0 110.491 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -61.4 -41.93 97.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.103 -179.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.4 mt -60.27 -44.2 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.288 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -52.12 -23.95 6.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.753 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -66.58 -38.4 86.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.51 -36.94 65.82 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.812 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptt -52.95 -32.99 48.97 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.143 0.497 . . . . 0.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.5 tt0 -68.95 -33.67 74.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.603 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -63.57 -51.86 63.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.616 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.401 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 9.0 pt -73.96 -45.48 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.291 0.567 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.1 tt0 -67.61 -38.87 84.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.263 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.422 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 5.7 ttm -111.04 -164.07 0.89 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.596 0.713 . . . . 0.0 110.253 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -154.83 45.36 0.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.36 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -56.55 -46.01 80.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.129 0.49 . . . . 0.0 110.408 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t 176.81 67.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.397 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -161.35 -133.72 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 110.358 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -156.69 -168.67 2.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.185 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 60.9 tttp -80.34 -104.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.552 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.7 tt -64.86 -35.46 75.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.65 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -67.44 12.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.623 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -77.93 -45.73 23.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.118 0.485 . . . . 0.0 110.585 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -61.06 -43.94 98.12 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.526 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' A' ' 30' ' ' MET . 26.4 t-20 -50.25 -40.33 47.52 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.493 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -78.59 -55.42 5.21 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.755 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 78.8 t80 -59.49 -48.92 79.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.188 0.518 . . . . 0.0 110.681 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.655 ' O ' HG23 ' A' ' 38' ' ' VAL . 64.7 t80 -54.56 -44.39 72.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.859 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -71.28 -28.02 63.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.9 m -70.03 -48.02 59.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.037 0.446 . . . . 0.0 110.711 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -71.26 -45.26 71.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.466 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.2 t -55.26 -42.48 66.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.29 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.5 p -64.5 -25.9 68.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.78 0.324 . . . . 0.0 110.498 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 94.4 m -84.21 -45.69 12.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.718 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.468 HD22 ' HG2' ' A' ' 55' ' ' ARG . 92.8 mt -58.92 -43.06 91.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.867 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 p -70.79 -27.37 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 121.463 0.649 . . . . 0.0 110.931 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.529 ' O ' ' C ' ' A' ' 44' ' ' ASP . 66.4 mt-30 -86.04 -28.44 24.14 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.629 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.529 ' C ' ' O ' ' A' ' 43' ' ' GLN . 77.0 m-20 -24.96 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 47' ' ' THR . 10.4 pt20 -156.55 7.68 0.2 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.051 0.453 . . . . 0.0 110.627 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.477 ' C ' ' O ' ' A' ' 45' ' ' GLN . 1.0 OUTLIER 27.93 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.486 0.66 . . . . 0.0 111.075 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 45' ' ' GLN . 9.8 t -60.53 -29.92 69.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.588 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -157.99 126.31 5.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.58 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.401 ' CG ' ' ND2' ' B' ' 49' ' ' ASN . 17.1 p30 -46.74 -35.82 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.198 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.68 70.37 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.888 0.375 . . . . 0.0 110.697 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.56 -45.07 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.642 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.35 -41.16 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.114 0.483 . . . . 0.0 110.925 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.68 -48.52 74.44 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.052 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.42 -43.58 93.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.802 0.81 . . . . 0.0 110.411 -178.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.468 ' HG2' HD22 ' A' ' 41' ' ' LEU . 19.5 tpt85 -63.35 -37.03 85.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.129 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.25 -45.18 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.419 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.99 -36.62 72.89 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.381 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.6 m170 -72.63 -43.5 63.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.34 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -53.56 -30.43 41.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.748 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -51.77 -29.2 17.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -60.96 -32.51 72.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.3 -56.56 5.78 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.729 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -44.99 66.36 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.976 0.417 . . . . 0.0 110.121 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.74 -35.53 80.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.0 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -57.34 -42.78 82.61 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.457 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.8 -49.68 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 121.536 0.684 . . . . 0.0 110.484 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.97 -43.38 92.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.82 0.819 . . . . 0.0 111.523 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.05 -23.3 63.63 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.109 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.41 -17.85 20.73 Favored Glycine 0 N--CA 1.465 0.597 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 5.8 mm-40 . . . . . 0 N--CA 1.465 0.323 0 CA-C-O 121.354 0.597 . . . . 0.0 110.323 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 CA-C-O 120.98 0.419 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.632 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -55.77 -50.53 86.6 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.807 178.65 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.632 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 5.7 Cg_endo -44.62 -17.49 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.987 1.792 . . . . 0.0 112.217 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . 0.437 ' N ' ' O ' ' B' ' 7' ' ' VAL . 81.0 t80 -69.28 -43.01 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.154 0.502 . . . . 0.0 110.433 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -68.21 -46.09 71.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.659 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' B' ' 14' ' ' LEU . 40.6 mt -62.8 -43.61 98.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.086 0.47 . . . . 0.0 110.29 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -46.34 -21.96 0.21 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.205 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . 0.416 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 46.4 m-20 -73.03 -39.29 66.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.905 0.383 . . . . 0.0 110.363 179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.611 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.3 mp -71.13 -37.01 72.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.64 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -55.98 -42.31 76.1 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.323 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -66.92 -31.63 72.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.416 ' CD2' ' O ' ' B' ' 13' ' ' ASN . 45.1 m170 -66.98 -51.73 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.156 0.503 . . . . 0.0 110.672 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.1 pt -74.11 -43.69 51.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.833 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.7 -53.61 21.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 8.5 tpp -88.15 -157.87 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.5 0.666 . . . . 0.0 109.992 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -157.74 46.28 0.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.321 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -63.03 -51.98 64.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.252 0.549 . . . . 0.0 110.497 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.7 p -174.91 72.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -166.52 -136.2 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.991 0.424 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -157.44 -158.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 64.1 tttm -94.91 -103.01 0.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.431 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 1.6 mm -61.59 -36.71 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.64 4.86 2.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.613 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.98 -50.24 20.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.723 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.543 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -61.46 -43.52 98.73 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.253 179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.543 ' N ' ' SD ' ' B' ' 30' ' ' MET . 15.0 m120 -53.71 -48.46 69.55 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.587 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -66.91 -53.22 34.16 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.818 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 57.0 t80 -61.79 -50.06 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.26 0.553 . . . . 0.0 110.849 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.642 ' O ' HG23 ' B' ' 38' ' ' VAL . 75.1 t80 -54.71 -45.52 74.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.722 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -68.62 -37.0 79.4 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.617 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 55.2 m -61.96 -44.18 97.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.217 0.532 . . . . 0.0 110.772 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.7 t -72.05 -46.27 59.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.597 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 34' ' ' TYR . 38.0 t -50.47 -44.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.351 -179.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 10.7 t -63.39 -34.64 78.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.191 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -72.61 -49.92 28.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.143 0.497 . . . . 0.0 110.936 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.441 ' CD2' ' NH2' ' B' ' 55' ' ' ARG . 97.3 mt -50.91 -34.93 30.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.948 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.5 t -87.77 -32.81 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.441 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -119.72 82.58 1.91 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.527 0.68 . . . . 0.0 110.176 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -167.64 -71.22 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.998 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.644 ' NE2' HH12 ' B' ' 55' ' ' ARG . 5.2 pt20 -105.54 -38.35 6.48 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.342 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 tp 37.85 54.19 1.56 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.787 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.424 ' H ' HG22 ' B' ' 47' ' ' THR . 2.5 t -83.89 -24.79 30.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.405 ' O ' HG23 ' B' ' 52' ' ' VAL . 35.6 tptt -173.78 138.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.751 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.536 ' ND2' ' N ' ' B' ' 50' ' ' ALA . 2.1 p-10 -54.59 -46.15 73.71 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.808 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.536 ' N ' ' ND2' ' B' ' 49' ' ' ASN . . . -58.66 -45.7 88.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.432 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.67 -34.34 47.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.005 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 48' ' ' LYS . 39.3 t -81.89 -45.07 20.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.591 0.71 . . . . 0.0 111.1 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -52.35 65.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.907 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.437 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.2 pttp -53.36 -40.58 65.06 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.644 HH12 ' NE2' ' B' ' 45' ' ' GLN . 77.3 mtp180 -68.34 -37.28 80.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.118 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 4.3 mm -64.38 -50.65 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.459 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -61.39 -37.22 82.61 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.255 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.496 ' CE1' ' OE2' ' B' ' 61' ' ' GLU . 5.7 t-80 -67.55 -46.98 71.16 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.888 0.375 . . . . 0.0 110.233 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.7 tp -49.88 -30.43 10.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.685 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -52.21 -30.83 29.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.7 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.496 ' OE2' ' CE1' ' B' ' 58' ' ' HIS . 9.5 pt-20 -58.1 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.602 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.43 -53.47 28.83 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.836 0.35 . . . . 0.0 110.475 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -46.28 72.04 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 110.193 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.476 ' ND2' ' CZ ' ' B' ' 68' ' ' ARG . 49.9 t30 -63.75 -36.67 84.65 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.315 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 30.5 tptt -60.26 -33.6 72.53 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.61 -43.15 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 122.028 0.918 . . . . 0.0 110.515 -178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.406 ' HZ3' ' HB3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -69.0 -44.77 72.13 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.655 -179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . 0.476 ' CZ ' ' ND2' ' B' ' 64' ' ' ASN . 87.2 mtm180 -66.82 -21.93 66.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.336 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.69 -70.1 1.24 Allowed Glycine 0 N--CA 1.463 0.453 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' B' ' 26' ' ' LYS . 2.7 pp20? . . . . . 0 N--CA 1.472 0.627 0 CA-C-O 121.686 0.755 . . . . 0.0 111.464 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.924 0.393 . . . . 0.0 110.18 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.577 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -67.66 -41.8 32.16 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.868 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 52.4 Cg_exo -52.85 -24.82 25.25 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.02 1.814 . . . . 0.0 111.92 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -61.62 -47.2 86.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.842 0.353 . . . . 0.0 110.331 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.448 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 2.9 m-85 -59.41 -40.47 86.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.293 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.9 mt -64.71 -43.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-O 121.032 0.444 . . . . 0.0 110.295 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -52.02 -25.76 9.23 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.735 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -73.21 -35.46 66.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.269 0.557 . . . . 0.0 110.621 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.0 mt -70.55 -37.37 74.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.323 -179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -52.28 -39.67 60.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.069 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.01 -31.86 73.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.586 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.32 -51.95 46.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.697 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 10.9 pt -72.95 -44.32 57.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 80.4 tt0 -53.94 -55.34 27.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.45 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 58.2 mtm -113.11 -133.34 0.34 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.921 0.391 . . . . 0.0 110.202 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p30 -171.48 52.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.332 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -45.08 74.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.491 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -174.56 62.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -166.17 -133.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.399 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -157.39 -162.95 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 110.325 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.406 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 64.2 tttm -83.44 -104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.356 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.528 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.8 mt -66.11 -37.42 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -63.69 6.47 0.15 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.612 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.528 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.16 -45.8 22.28 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.466 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.61 -44.85 95.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.479 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.573 ' N ' ' SD ' ' A' ' 30' ' ' MET . 39.2 t30 -51.63 -50.69 59.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.557 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.0 m -65.51 -53.38 43.15 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.633 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.448 ' OH ' ' CD1' ' A' ' 10' ' ' PHE . 4.9 t80 -61.46 -23.46 65.89 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.368 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 30' ' ' MET . 82.8 t80 -76.74 -57.61 3.76 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.376 0.608 . . . . 0.0 110.953 -178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -23.81 66.84 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.979 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.0 p -71.2 -49.88 38.91 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.541 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 79.8 t -70.8 -56.35 11.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.934 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.2 t -49.97 -48.04 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.501 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.2 m -54.96 -52.29 63.5 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.798 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.0 m -68.92 -44.17 73.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.754 0.788 . . . . 0.0 110.981 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -59.72 -40.69 88.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.432 -178.784 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 42' ' ' VAL . 26.5 t -96.0 26.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.106 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -165.9 27.77 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -154.54 17.48 0.46 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.705 0.288 . . . . 0.0 110.541 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.407 ' HG2' ' H ' ' A' ' 47' ' ' THR . 57.1 tt0 -153.38 -77.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.359 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.405 HD11 HE22 ' B' ' 57' ' ' GLN . 4.8 tp 59.41 41.41 19.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 110.642 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 33.8 m -70.85 -40.49 72.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.51 0.671 . . . . 0.0 110.966 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 63.7 tttp -175.53 143.15 0.61 Allowed 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.627 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' HB2' ' B' ' 50' ' ' ALA . 65.7 m-20 -50.08 -45.93 52.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.724 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.4 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -64.07 -46.91 82.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.706 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 49.9 t -57.02 -47.23 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.863 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.557 HG23 ' N ' ' A' ' 53' ' ' LEU . 15.9 m -76.55 -46.65 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.66 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.557 ' N ' HG23 ' A' ' 52' ' ' VAL . 60.0 tp -51.3 -58.6 5.76 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.884 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.472 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 17.5 pttm -50.5 -35.63 30.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.851 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 tpt85 -66.34 -44.7 82.54 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.199 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 50.6 mm -63.57 -52.51 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.487 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -56.61 -39.4 73.54 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.472 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -68.99 -44.0 73.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.273 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 tp -60.2 -33.68 72.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.87 0.367 . . . . 0.0 110.434 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -51.4 -39.55 57.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.541 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.75 -29.16 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.11 -54.0 21.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.773 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.7 -43.06 72.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.158 0.504 . . . . 0.0 110.118 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -66.07 -37.37 85.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.621 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.5 mmpt? -62.0 -34.58 76.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.239 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.58 -46.04 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.363 0.602 . . . . 0.0 110.153 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -67.96 -42.84 80.27 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.497 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -80.67 -10.41 59.73 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.151 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -97.66 -26.12 10.15 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.436 ' OE2' HD11 ' A' ' 27' ' ' ILE . 1.5 pp20? . . . . . 0 C--N 1.328 -0.347 0 CA-C-O 120.893 0.377 . . . . 0.0 110.329 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . 0.452 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 46.6 t . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 120.588 0.232 . . . . 0.0 110.845 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.9 t -56.01 -55.59 39.84 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 46.6 Cg_exo -34.82 -26.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.052 1.835 . . . . 0.0 113.126 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 7' ' ' VAL . 89.8 t80 -56.65 -40.07 74.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.356 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.23 -45.39 91.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.072 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.57 -43.99 83.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.319 0.581 . . . . 0.0 110.384 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -50.59 -25.86 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.507 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -76.08 -34.54 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.246 0.546 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.8 mt -73.25 -40.03 64.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.537 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.42 -37.11 74.69 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.997 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.424 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.4 tt0 -66.59 -41.43 88.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -59.08 -49.55 77.45 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.858 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.8 pt -73.31 -40.67 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.618 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -72.06 -60.42 2.24 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.144 -0.623 . . . . 0.0 110.964 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.53 ' SD ' ' N ' ' B' ' 20' ' ' MET . 0.0 OUTLIER -81.43 -66.29 0.91 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.76 HD21 ' N ' ' B' ' 25' ' ' ASP . 7.2 t-20 75.46 46.84 0.11 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -54.32 -41.35 68.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.008 0.432 . . . . 0.0 110.583 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 38.2 t -161.63 66.09 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.601 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . 0.443 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 29.2 tp10 -158.03 -127.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.394 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . 0.76 ' N ' HD21 ' B' ' 21' ' ' ASN . 62.3 m-20 -160.68 -172.41 3.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.239 0.543 . . . . 0.0 110.109 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -83.38 -103.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.288 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.04 -34.11 64.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.738 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -64.57 -5.56 5.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.28 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.6 -49.95 71.35 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.969 0.414 . . . . 0.0 110.682 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.533 ' O ' ' N ' ' B' ' 34' ' ' TYR . 12.2 tmm? -56.45 -48.35 77.25 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.797 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -52.83 -39.47 62.5 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.388 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.443 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 7.9 t -73.36 -54.5 8.17 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.116 -0.633 . . . . 0.0 110.773 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.409 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 38.0 t80 -63.08 -25.07 68.2 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.082 0.467 . . . . 0.0 110.973 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.721 ' O ' HG23 ' B' ' 38' ' ' VAL . 29.7 t80 -72.82 -51.27 19.55 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.367 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.532 HH22 ' CG ' ' A' ' 31' ' ' ASN . 19.7 ptp180 -72.48 -20.52 61.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.54 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.8 t -70.8 -54.25 12.34 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.71 -178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.511 HG23 ' N ' ' B' ' 38' ' ' VAL . 30.2 m -69.04 -43.39 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.35 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 34' ' ' TYR . 48.3 t -49.97 -51.64 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.412 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 88.5 p -56.76 -45.91 81.75 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.493 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 93.6 m -68.31 -48.37 65.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.073 0.463 . . . . 0.0 110.873 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 78.0 mt -58.12 -45.78 86.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.515 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 73.2 t -69.41 -40.15 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -70.56 -29.33 65.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.901 ' O ' ' O ' ' B' ' 45' ' ' GLN . 38.5 m-20 -103.69 -150.39 0.42 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.831 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.901 ' O ' ' O ' ' B' ' 44' ' ' ASP . 46.2 tt0 34.13 130.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.942 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.51 87.74 1.18 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.625 0.726 . . . . 0.0 109.727 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -141.26 -27.45 0.69 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.344 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -179.21 141.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 111.091 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 15.9 p30 -59.9 -38.5 82.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.565 ' HB2' ' ND2' ' A' ' 49' ' ' ASN . . . -64.32 -39.97 94.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.426 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 38.0 t -61.42 -62.7 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.537 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.52 -31.99 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.34 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 51.4 tp -69.73 -42.2 74.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.34 0.591 . . . . 0.0 110.895 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.474 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 24.1 pttt -53.48 -37.29 62.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.217 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.64 ' HE ' HE22 ' B' ' 45' ' ' GLN . 92.3 mtt-85 -65.15 -30.46 71.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.348 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 20.8 mm -74.52 -46.78 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.33 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . 0.405 HE22 HD11 ' A' ' 46' ' ' LEU . 93.5 mt-30 -64.47 -24.57 67.66 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.08 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 1.6 m-70 -65.63 -50.47 64.89 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.58 -20.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' B' ' 58' ' ' HIS . 81.6 m-20 -52.29 -45.45 65.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.381 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.401 ' CG ' ' N ' ' B' ' 62' ' ' ALA . 8.2 pt-20 -62.82 -41.13 99.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.529 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . 0.401 ' N ' ' CG ' ' B' ' 61' ' ' GLU . . . -71.96 -47.14 54.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.891 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -42.69 58.15 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.102 0.477 . . . . 0.0 109.84 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.78 -36.31 80.24 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.551 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -62.58 -40.86 98.22 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.35 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.9 t -59.75 -50.49 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.253 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -51.19 18.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.078 0.942 . . . . 0.0 111.749 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.52 -36.13 68.84 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.859 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.37 -9.27 67.94 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 . . . . . 0 N--CA 1.467 0.396 0 CA-C-O 121.131 0.491 . . . . 0.0 110.428 179.947 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.032 0.444 . . . . 0.0 110.249 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.587 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.1 t -67.33 -39.17 18.89 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.998 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.587 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -52.93 -21.67 16.25 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.896 1.731 . . . . 0.0 112.087 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -65.22 -43.86 90.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 110.635 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.454 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -64.01 -44.27 93.11 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.584 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.46 HD13 ' HD3' ' A' ' 65' ' ' LYS . 25.1 mt -66.77 -42.26 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.519 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -49.42 -26.06 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.251 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.13 -33.34 70.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.402 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ILE . 36.4 mt -72.15 -37.41 69.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.594 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.48 -38.98 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.136 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -65.55 -35.6 81.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.451 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.09 -51.42 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.654 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 19' ' ' GLU . 13.4 pt -74.45 -43.91 48.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.179 0.514 . . . . 0.0 111.025 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' HG13 ' A' ' 18' ' ' ILE . 82.2 tt0 -64.73 -52.15 58.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.543 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 35.7 mtt -104.75 -161.92 0.85 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.198 0.523 . . . . 0.0 110.022 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -150.78 47.91 0.86 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -57.14 -49.58 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.517 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.4 p -175.45 68.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.496 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -167.12 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.4 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -158.35 -166.25 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.121 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -80.91 -106.07 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.552 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.549 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.3 tt -64.57 -37.14 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 120.954 0.407 . . . . 0.0 110.568 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.85 9.79 0.08 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.588 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.07 -42.64 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -62.01 -47.05 86.52 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.166 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.676 ' ND2' ' HE ' ' B' ' 35' ' ' ARG . 36.8 t-20 -51.9 -43.71 63.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.481 -178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.8 m -71.11 -54.11 12.25 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.959 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.454 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 49.5 t80 -61.25 -43.79 98.3 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.746 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 39.2 t80 -58.56 -47.97 82.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.797 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.45 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 81.3 mtp180 -69.16 -27.67 65.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.376 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.7 t -66.46 -46.68 75.58 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.541 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.1 t -68.28 -45.87 81.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.513 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.5 t -51.87 -47.85 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.411 -179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 t -57.32 -42.66 82.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.435 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.9 m -64.88 -45.28 86.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.941 0.4 . . . . 0.0 110.746 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.58 -47.17 85.17 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.614 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.5 t -71.68 -38.33 66.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.781 0.325 . . . . 0.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -71.76 -33.28 68.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.637 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 1.129 ' O ' ' O ' ' A' ' 45' ' ' GLN . 30.5 m-20 -74.59 173.83 9.88 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 1.129 ' O ' ' O ' ' A' ' 44' ' ' ASP . 15.3 pt20 5.64 -164.01 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 117.472 -1.251 . . . . 0.0 113.268 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.11 28.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.553 1.069 . . . . 0.0 109.769 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' N ' ' A' ' 48' ' ' LYS . 8.2 t -60.28 -42.57 95.72 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.334 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.594 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 82.5 tttt -162.82 135.41 5.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.429 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -62.22 -10.17 9.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.533 0.683 . . . . 0.0 111.521 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -73.88 -51.69 15.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.149 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 52' ' ' VAL . 12.0 m -59.26 -56.44 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.524 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.659 ' N ' HG23 ' A' ' 51' ' ' VAL . 4.3 m -51.81 -33.19 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-O 121.379 0.609 . . . . 0.0 110.391 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.426 ' HA ' HD12 ' A' ' 56' ' ' ILE . 5.0 tt -74.68 -29.66 61.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.549 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.454 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 11.2 pttm -51.99 -37.89 54.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.619 0.724 . . . . 0.0 110.315 -179.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -75.71 -37.2 59.65 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.308 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' A' ' 53' ' ' LEU . 67.7 mt -58.66 -50.61 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.14 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -58.62 -37.05 75.04 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.454 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 9.0 m-70 -74.55 -39.75 62.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.368 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -53.4 -34.74 58.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.346 -178.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -50.26 -26.19 4.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.551 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.99 -37.85 83.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.781 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.97 -49.51 28.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -39.46 34.21 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.938 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -64.74 -41.04 96.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.444 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HD3' HD13 ' A' ' 11' ' ' ILE . 51.8 mtpt -64.26 -33.11 75.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.307 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.04 -42.78 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-O 121.695 0.759 . . . . 0.0 110.344 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HD2' HD11 ' A' ' 27' ' ' ILE . 18.4 mmmt -66.68 -46.86 74.26 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.163 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -78.05 -14.66 59.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.339 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.84 -40.22 5.32 Favored Glycine 0 N--CA 1.47 0.932 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.525 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.2 pp20? . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 110.422 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.861 0.362 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.7 t -71.02 -39.96 9.03 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.892 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 64.6 Cg_exo -52.42 -15.77 4.34 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.987 1.792 . . . . 0.0 112.034 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -67.57 -51.57 49.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.944 0.402 . . . . 0.0 110.378 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.408 ' CD2' HD21 ' B' ' 59' ' ' LEU . 0.2 OUTLIER -61.91 -40.82 96.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.311 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -63.12 -42.8 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.509 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -49.13 -23.78 1.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.586 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.417 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.641 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.1 mp -70.15 -39.72 75.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.533 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -57.14 -31.58 65.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.046 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.97 -35.39 80.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.52 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -62.58 -52.05 64.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.879 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.7 -43.87 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.408 0.623 . . . . 0.0 110.806 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -63.91 -23.8 67.49 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.473 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 36.6 mtt -138.6 -146.89 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.109 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -170.08 39.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.223 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . 0.404 ' O ' ' OG ' ' B' ' 23' ' ' SER . 1.1 tm0? -50.99 -40.2 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.967 0.413 . . . . 0.0 110.756 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 5.0 m -177.46 64.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.185 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -164.66 -135.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.312 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -157.23 -161.31 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.26 0.552 . . . . 0.0 110.318 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . 0.422 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 62.0 tttm -86.49 -103.59 0.07 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.352 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.517 ' C ' ' H ' ' B' ' 29' ' ' ALA . 44.8 mm -64.6 -40.99 90.97 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -61.16 3.39 0.1 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.789 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.517 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -74.08 -44.87 52.45 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.55 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.576 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.83 -47.23 84.29 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.25 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.604 HD21 ' ND2' ' A' ' 31' ' ' ASN . 2.0 t30 -54.97 -53.36 56.66 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.714 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -62.49 -53.29 57.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.833 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.61 ' CE2' HD11 ' B' ' 14' ' ' LEU . 77.7 t80 -60.38 -49.08 78.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.495 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.437 ' CB ' ' O ' ' B' ' 30' ' ' MET . 35.3 t80 -57.86 -54.56 45.48 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.794 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.676 ' HE ' ' ND2' ' A' ' 31' ' ' ASN . 6.9 tmm_? -61.63 -32.73 72.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 121.155 0.503 . . . . 0.0 110.429 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -68.75 -44.14 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.771 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 38.5 t -66.59 -63.95 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.646 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.578 HG23 ' N ' ' B' ' 39' ' ' SER . 20.2 m -48.5 -45.87 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.518 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.578 ' N ' HG23 ' B' ' 38' ' ' VAL . 46.1 t -60.15 -41.08 91.98 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.281 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -69.0 -49.21 59.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.968 0.413 . . . . 0.0 110.708 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.66 -40.4 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.514 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.672 ' O ' HG12 ' B' ' 42' ' ' VAL . 60.7 t -85.1 19.76 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.076 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -162.12 21.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -161.98 14.14 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -172.6 55.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.545 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 mt -87.67 48.63 1.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.409 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -72.28 -27.17 62.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.31 0.576 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -172.32 133.74 0.67 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.868 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' B' ' 53' ' ' LEU . 10.0 m120 -52.38 -42.87 64.35 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.465 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.59 86.99 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.939 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -51.97 -44.23 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.434 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.46 -39.75 23.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.185 0.516 . . . . 0.0 110.642 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' B' ' 49' ' ' ASN . 0.2 OUTLIER -55.44 -58.62 7.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.912 -178.4 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -55.71 -37.96 69.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.365 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -64.2 -41.34 97.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.481 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.425 ' O ' ' N ' ' B' ' 59' ' ' LEU . 94.3 mt -65.74 -49.0 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.264 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -49.41 -30.85 8.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.237 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -71.42 -29.24 64.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' B' ' 56' ' ' ILE . 0.4 OUTLIER -77.46 -26.32 51.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.125 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -61.94 -54.6 39.54 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.455 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -62.35 -26.45 68.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.703 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -52.09 17.62 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 120.826 0.346 . . . . 0.0 110.851 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.433 ' CD1' ' C ' ' B' ' 63' ' ' TYR . 0.0 OUTLIER -53.35 -44.68 68.7 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.017 -179.661 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -66.58 -31.17 71.7 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.159 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -63.61 -31.27 72.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.531 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -63.75 -55.44 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.3 0.572 . . . . 0.0 110.656 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -69.8 -46.37 65.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.347 1.07 . . . . 0.0 111.881 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -44.27 -35.93 2.52 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.068 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.49 -55.76 4.15 Favored Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.642 0.258 . . . . 0.0 110.844 -179.782 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.485 ' O ' ' N ' ' A' ' 9' ' ' TYR . 3.2 t . . . . . 0 N--CA 1.472 0.636 0 CA-C-O 118.796 -0.621 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.474 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -34.22 -53.03 0.93 Allowed Pre-proline 0 N--CA 1.482 1.171 0 CA-C-N 118.225 0.466 . . . . 0.0 111.146 178.276 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 11.3 Cg_endo -51.29 -21.17 9.31 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 120.407 0.738 . . . . 0.0 112.671 178.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 6' ' ' SER . 7.3 t80 -62.2 -42.96 99.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.341 0.591 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.1 -52.49 6.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.879 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.2 mt -53.66 -35.85 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.601 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -49.3 -31.07 8.37 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.22 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.476 ' OD1' ' NE2' ' A' ' 17' ' ' HIS . 53.4 t-20 -72.37 -45.34 60.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.211 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 ' CD1' ' A' ' 33' ' ' TYR . 56.5 mt -61.45 -42.5 98.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.613 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.31 -38.84 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -69.04 -33.92 74.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.685 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.476 ' NE2' ' OD1' ' A' ' 13' ' ' ASN . 8.8 m-70 -63.62 -51.74 63.92 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.715 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.5 pt -70.17 -42.54 79.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.119 0.485 . . . . 0.0 110.938 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -57.63 -52.2 66.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.206 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 63.6 mtm -114.29 -125.53 0.28 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.432 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -170.07 61.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.396 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.19 51.74 0.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.968 0.889 . . . . 0.0 110.91 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 23' ' ' SER . 3.4 p 77.42 46.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.257 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -147.18 -142.88 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.627 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -153.54 -168.28 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.234 0.54 . . . . 0.0 110.657 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.33 -100.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.176 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.647 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.0 tp -63.53 -42.45 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.467 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.5 m-70 -63.82 19.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.873 0.368 . . . . 0.0 110.99 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.647 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -79.73 -46.7 16.57 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.268 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.557 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.98 -50.64 65.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.252 -179.2 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.478 ' N ' ' SD ' ' A' ' 30' ' ' MET . 82.5 m-20 -51.41 -38.55 54.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.453 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 t -77.2 -54.26 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.615 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.552 ' CD1' HD21 ' A' ' 14' ' ' LEU . 58.4 t80 -63.95 -47.69 79.45 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.18 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.551 ' N ' ' O ' ' A' ' 30' ' ' MET . 57.7 t80 -55.56 -51.77 65.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.751 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.6 ttt85 -63.35 -34.73 78.35 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -63.93 -42.52 97.33 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.364 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.98 -56.83 9.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.376 -0.529 . . . . 0.0 110.171 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.7 t -50.01 -45.35 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.417 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.1 m -68.69 -18.74 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.668 0.27 . . . . 0.0 110.416 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.512 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.4 m -88.63 -54.31 4.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.066 0.46 . . . . 0.0 110.961 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.5 mt -61.5 -39.5 91.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.445 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 p -69.31 -25.53 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.4 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -98.75 -22.13 16.03 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.191 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 40' ' ' THR . 14.3 m-20 -91.04 -34.77 14.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.948 0.404 . . . . 0.0 110.518 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.441 HE22 ' CZ ' ' A' ' 55' ' ' ARG . 9.5 tt0 -106.98 161.6 14.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.374 0.607 . . . . 0.0 110.211 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -168.27 22.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.367 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 49.9 m -61.5 -42.99 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.467 0.651 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 8.3 ttmt -173.86 141.51 0.81 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.703 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -48.78 -38.39 21.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.38 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.498 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -69.03 -50.16 51.1 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.351 -0.539 . . . . 0.0 110.765 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 37.5 t -52.41 -43.57 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.499 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.4 m -78.69 -37.92 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.242 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -62.28 -46.29 89.42 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.098 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 17.9 ptmt -54.85 -40.93 70.15 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.03 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.441 ' CZ ' HE22 ' A' ' 45' ' ' GLN . 93.1 mtt180 -63.95 -39.54 94.38 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.824 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.9 mt -69.06 -48.66 68.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.6 -34.4 71.08 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.411 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 51.0 m170 -76.56 -43.14 40.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.871 0.367 . . . . 0.0 110.358 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.4 tp -48.76 -22.63 0.84 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.447 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 10.8 p-10 -58.6 -26.66 63.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.021 0.438 . . . . 0.0 110.416 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 10.4 pt-20 -60.85 -38.63 86.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.407 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.28 -55.06 10.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.401 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.665 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -51.23 -46.07 62.17 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.264 0.554 . . . . 0.0 110.211 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -61.66 -33.09 73.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.128 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.6 tptm -62.8 -39.61 94.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.85 -48.72 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.339 0.59 . . . . 0.0 110.132 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -42.71 93.54 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 122.016 0.912 . . . . 0.0 111.523 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -60.87 -34.85 75.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.942 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.2 -25.57 28.41 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 110.864 -0.895 . . . . 0.0 110.864 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 121.131 0.491 . . . . 0.0 110.253 -179.442 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 110.472 -0.195 . . . . 0.0 110.472 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.496 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 18.7 t -46.22 -43.27 32.7 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.369 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 23.8 Cg_exo -66.16 -20.75 56.19 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 120.401 0.734 . . . . 0.0 111.805 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.52 -57.43 3.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.341 0.591 . . . . 0.0 110.942 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -43.91 -47.45 8.4 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.622 -178.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 70.4 mt -66.46 -48.19 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.38 0.61 . . . . 0.0 111.234 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.24 -27.82 0.7 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.716 -178.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' B' ' 17' ' ' HIS . 18.9 m120 -75.13 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.307 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 34.8 mt -61.63 -43.25 99.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.225 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -59.06 -44.03 91.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 20' ' ' MET . 56.5 tt0 -67.57 -29.5 68.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.89 0.376 . . . . 0.0 110.245 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' B' ' 13' ' ' ASN . 47.8 m170 -67.95 -53.69 24.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -72.97 -43.48 58.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.132 0.492 . . . . 0.0 110.707 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -69.56 -48.36 60.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.353 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.437 ' CB ' ' O ' ' B' ' 16' ' ' GLN . 3.9 tpp -99.94 -163.7 1.05 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.357 0.599 . . . . 0.0 110.19 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -155.78 41.55 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.436 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -58.88 -49.2 78.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.469 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -175.45 69.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -163.8 -148.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.083 0.468 . . . . 0.0 110.201 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -142.76 -164.46 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.363 0.601 . . . . 0.0 110.43 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -88.81 -104.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.441 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.536 HD13 ' OE1' ' B' ' 70' ' ' GLU . 7.0 tp -61.05 -40.67 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . 0.452 ' N ' HG23 ' B' ' 27' ' ' ILE . 77.5 m80 -60.02 -14.5 16.59 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.261 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.97 -45.08 51.21 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.525 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 14.0 ptt? -63.4 -52.14 62.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.316 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.525 ' N ' ' CG ' ' B' ' 30' ' ' MET . 97.8 m-20 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.775 -178.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.6 t -63.11 -45.33 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.57 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -75.25 -46.75 31.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.804 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.434 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.2 t80 -49.02 -51.3 31.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.766 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.665 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 67.5 ttt-85 -66.41 -28.94 69.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 5.6 t -62.27 -44.23 97.01 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' B' ' 41' ' ' LEU . 66.4 t -70.79 -58.92 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.862 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -49.43 -49.26 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.763 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 59.7 p -49.04 -61.26 2.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.383 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -73.0 -44.66 60.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 122.443 1.116 . . . . 0.0 111.534 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' B' ' 37' ' ' VAL . 53.6 tp -53.53 -28.51 31.77 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.512 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.686 ' O ' HG12 ' B' ' 42' ' ' VAL . 96.1 t -96.48 21.9 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.16 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -138.05 -2.29 1.89 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.457 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -101.83 -38.62 7.76 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 110.358 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -110.29 174.13 6.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.522 0.677 . . . . 0.0 110.018 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -178.61 26.3 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.208 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -71.7 -34.18 69.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.357 0.598 . . . . 0.0 110.725 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 tptm -169.35 129.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.621 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -49.43 -32.38 11.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.232 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.52 -50.77 34.2 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.318 0.58 . . . . 0.0 110.702 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.9 t -49.49 -43.67 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.447 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -75.98 -36.63 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 120.159 -0.616 . . . . 0.0 111.028 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.51 -35.61 81.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.648 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 65.2 mttm -54.6 -44.63 73.23 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.204 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -69.77 -40.78 75.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 80.1 mt -63.67 -54.65 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.801 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.15 -34.13 69.94 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 5.1 m-70 -76.61 -42.47 42.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.478 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 57.1 tp -47.07 -22.15 0.32 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.583 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 21.7 p-10 -58.94 -28.23 66.06 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.372 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 12.5 pt-20 -56.86 -40.48 76.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.343 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -51.44 32.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.571 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -39.21 15.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 121.035 0.445 . . . . 0.0 109.926 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.42 -34.17 77.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.561 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 tptt -57.32 -42.95 82.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.455 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.41 -47.3 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 122.286 1.041 . . . . 0.0 110.718 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.37 92.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.893 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 -67.02 -16.04 64.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.065 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.52 -63.98 1.12 Allowed Glycine 0 N--CA 1.463 0.441 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.536 ' OE1' HD13 ' B' ' 27' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 110.626 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.722 0.296 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.5 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 78.1 t -59.47 -44.84 98.58 Favored Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-O 119.036 -0.506 . . . . 0.0 109.858 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -44.7 -31.72 5.25 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.241 1.294 . . . . 0.0 112.317 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.55 -43.05 89.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.923 0.392 . . . . 0.0 110.237 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -66.1 -45.54 80.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.458 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.34 -50.44 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.92 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -47.29 -39.94 15.73 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.676 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -51.84 -30.49 23.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.315 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.58 -41.22 63.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.568 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -54.78 -34.13 62.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 120.92 0.391 . . . . 0.0 110.177 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -64.34 -27.44 69.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.333 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.422 ' O ' ' CA ' ' A' ' 21' ' ' ASN . 2.0 m-70 -71.71 -52.86 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.6 pt -73.98 -38.19 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.446 0.641 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -62.58 -44.67 95.73 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.691 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.443 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 28.8 ttp -114.96 -65.06 1.23 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.294 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.443 ' CB ' ' O ' ' A' ' 20' ' ' MET . 5.6 t30 81.48 45.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -55.18 -37.41 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.166 0.507 . . . . 0.0 110.556 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.1 m -158.12 63.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.643 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -159.66 -130.93 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.981 0.419 . . . . 0.0 110.491 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 65.3 m-20 -159.39 167.66 28.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.197 0.523 . . . . 0.0 110.429 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 87.5 tttt -69.9 -99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.454 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.565 ' C ' ' H ' ' A' ' 29' ' ' ALA . 10.7 tp -61.14 -43.15 95.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.015 0.436 . . . . 0.0 110.637 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.503 ' N ' HG23 ' A' ' 27' ' ' ILE . 94.8 m-70 -67.72 17.91 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.642 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -58.97 -51.93 67.96 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' HG21 ' A' ' 66' ' ' VAL . 66.9 mmm -61.68 -44.55 96.74 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.106 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -46.55 -33.69 4.3 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.562 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 m -89.15 -57.11 3.01 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.913 0.387 . . . . 0.0 110.736 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CE2' ' A' ' 10' ' ' PHE . 38.6 t80 -61.37 -53.06 61.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 28.0 t80 -49.01 -49.55 40.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.234 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -66.5 -28.56 68.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.301 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.5 t -63.4 -46.18 87.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.359 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.458 ' O ' ' N ' ' A' ' 41' ' ' LEU . 35.3 t -71.0 -56.34 10.95 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.5 t -51.36 -47.67 34.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.454 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 p -53.82 -60.28 3.52 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.085 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.1 m -69.49 -44.58 70.81 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.919 0.866 . . . . 0.0 111.045 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' A' ' 37' ' ' VAL . 41.8 tp -56.26 -27.77 56.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.598 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 98.6 t -101.87 -33.64 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.205 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -80.16 -0.29 35.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.339 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 43.5 t0 -145.46 165.16 29.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.37 0.605 . . . . 0.0 110.252 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.3 tt0 72.42 -78.28 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.606 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt 42.09 41.15 1.9 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.403 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 11.4 t -73.4 -34.61 65.6 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.397 0.618 . . . . 0.0 110.79 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -167.49 133.68 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.784 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.9 m120 -49.72 -47.07 50.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.664 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.61 83.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.774 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.0 t -52.96 -43.84 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.547 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.451 ' O ' HG12 ' A' ' 56' ' ' ILE . 28.8 m -81.1 -46.33 20.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.161 0.505 . . . . 0.0 110.556 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.675 HD12 HE21 ' A' ' 57' ' ' GLN . 0.2 OUTLIER -57.15 -55.94 28.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.808 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 17.4 ptmt -50.99 -40.02 57.04 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.236 0.541 . . . . 0.0 110.411 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.439 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 40.0 ttm180 -65.08 -39.18 92.84 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.147 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 52' ' ' VAL . 34.3 mm -61.36 -52.95 55.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.247 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.675 HE21 HD12 ' A' ' 53' ' ' LEU . 75.8 mt-30 -52.52 -40.97 63.03 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.465 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 2.8 t-80 -66.97 -46.16 75.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.11 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 29.3 tp -53.0 -23.65 7.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.917 0.389 . . . . 0.0 110.598 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -55.64 -49.26 73.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.434 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.465 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 6.2 pt-20 -50.74 -28.59 9.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.684 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -68.56 -62.22 1.49 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.34 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.43 ' CE2' ' OD1' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -52.47 -38.89 60.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.038 0.447 . . . . 0.0 110.25 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 68' ' ' ARG . 61.4 m-80 -65.32 -27.64 68.74 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.165 -179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -75.88 -39.74 55.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.475 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.576 HG21 ' SD ' ' A' ' 30' ' ' MET . 99.1 t -63.03 -52.05 64.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.587 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -63.26 -44.96 93.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.801 0.81 . . . . 0.0 111.072 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 64' ' ' ASN . 12.1 mmm180 -55.34 -31.38 61.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.981 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.96 -22.31 61.53 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 . . . . . 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.391 . . . . 0.0 110.546 -179.935 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.453 -0.307 0 CA-C-O 120.945 0.403 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.549 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -57.32 -42.61 96.9 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.967 179.107 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.9 Cg_exo -50.16 -31.16 27.74 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 121.737 1.624 . . . . 0.0 112.097 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -59.98 -43.87 94.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 110.339 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.455 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -63.79 -46.43 85.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.215 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.3 mt -61.11 -47.04 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-O 121.052 0.453 . . . . 0.0 110.587 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -48.43 -35.0 11.91 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -58.39 -34.31 70.59 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.672 ' N ' HD12 ' B' ' 14' ' ' LEU . 6.6 mp -72.44 -37.23 68.62 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.246 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.82 -38.32 87.7 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.329 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -54.26 -24.93 20.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.556 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.425 ' O ' ' CA ' ' B' ' 21' ' ' ASN . 28.3 m170 -76.38 -54.62 6.49 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -70.84 -38.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.483 0.659 . . . . 0.0 110.625 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -63.72 -43.0 97.83 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 48.9 mtt -115.56 -65.16 1.22 Allowed 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.066 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.444 ' CB ' ' O ' ' B' ' 20' ' ' MET . 24.3 t30 82.9 46.78 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.831 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.7 -40.98 85.22 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.411 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -158.57 69.81 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.576 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -165.17 -125.32 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.076 0.465 . . . . 0.0 110.338 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -158.17 -175.92 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.33 0.586 . . . . 0.0 110.048 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -86.4 -98.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.444 ' C ' ' H ' ' B' ' 29' ' ' ALA . 4.3 mm -61.71 -43.16 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.436 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -62.14 -0.58 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.74 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.444 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.29 -49.86 74.73 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.114 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -68.67 -40.51 80.09 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.283 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' B' ' 30' ' ' MET . 40.7 t30 -55.54 -50.62 69.54 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.668 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.2 t -67.01 -51.45 54.75 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.696 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.604 ' CE1' HD11 ' B' ' 14' ' ' LEU . 54.1 t80 -61.43 -50.0 74.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.478 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' B' ' 30' ' ' MET . 39.4 t80 -55.98 -48.48 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.104 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -64.87 -34.36 78.19 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.857 0.361 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -67.75 -39.07 84.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.646 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.4 HG21 ' CE1' ' B' ' 33' ' ' TYR . 43.0 t -68.97 -63.45 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.401 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.522 HG23 ' N ' ' B' ' 39' ' ' SER . 23.7 m -50.55 -42.31 21.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.369 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.522 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.2 p -62.05 -46.23 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.419 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.1 m -63.65 -44.28 94.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.399 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.504 ' O ' ' O ' ' B' ' 44' ' ' ASP . 90.4 mt -70.37 -50.67 36.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.705 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 62.8 t -60.91 -19.19 19.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.082 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -103.62 6.69 37.3 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.855 0.36 . . . . 0.0 110.854 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.504 ' O ' ' O ' ' B' ' 41' ' ' LEU . 39.7 t0 -148.35 170.12 18.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.606 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.459 HE22 HH12 ' B' ' 55' ' ' ARG . 5.4 pt20 39.88 48.28 2.01 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.352 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.37 46.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.353 -179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.403 HG23 ' N ' ' B' ' 48' ' ' LYS . 3.6 t -61.04 -41.16 96.05 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.204 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.403 ' N ' HG23 ' B' ' 47' ' ' THR . 39.7 tptt -167.32 134.43 2.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.754 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -50.24 -37.51 36.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.539 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.98 -51.27 68.76 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.49 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 36.7 t -50.61 -38.65 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.988 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 5.2 t -80.76 -43.06 20.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.597 0.713 . . . . 0.0 111.008 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.93 -52.75 62.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.141 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.48 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 49.9 pttt -51.34 -42.39 61.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.48 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 78.3 mtp180 -65.71 -45.35 83.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.336 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.78 -54.83 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.739 -0.385 . . . . 0.0 110.362 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -53.2 -40.21 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.313 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 57.0 m170 -75.21 -38.27 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.275 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 52.8 tp -51.75 -32.28 30.03 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.63 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.95 -29.03 11.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.482 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -56.69 -35.57 68.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.6 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -60.83 2.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.486 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -43.43 22.22 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.961 0.41 . . . . 0.0 110.158 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -62.05 -39.66 93.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.293 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 tptm -66.74 -36.63 82.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.441 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.4 -51.07 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.232 0.539 . . . . 0.0 110.355 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -66.33 -48.39 70.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.267 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -61.08 -21.64 63.87 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.219 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.6 -27.11 48.52 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 110.336 -179.878 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.27 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.492 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.0 t -47.56 -42.64 44.77 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 118.854 -0.593 . . . . 0.0 110.245 179.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 37.8 Cg_exo -58.62 -22.89 62.71 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 120.754 0.97 . . . . 0.0 111.86 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.77 -48.35 77.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.912 0.387 . . . . 0.0 110.547 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.4 m-85 -48.83 -45.3 40.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.297 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 14' ' ' LEU . 45.9 mt -70.21 -50.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.695 0.76 . . . . 0.0 110.833 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -48.41 -24.13 1.15 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.412 -178.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -72.3 -36.47 68.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.45 . . . . 0.0 110.179 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 11' ' ' ILE . 17.0 mt -70.52 -48.12 57.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.387 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -59.02 -27.8 65.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.287 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -62.53 -27.52 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.18 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.472 ' CE1' ' C ' ' A' ' 24' ' ' GLU . 48.5 t60 -81.86 -60.69 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.488 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.417 ' H ' HG23 ' A' ' 18' ' ' ILE . 2.4 pt -50.9 -39.06 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.836 0.827 . . . . 0.0 110.259 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -72.21 -32.15 66.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.458 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.54 -121.77 0.15 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -174.61 72.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.357 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -77.21 -54.98 5.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.13 0.49 . . . . 0.0 110.198 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 m 170.61 78.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.367 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.472 ' C ' ' CE1' ' A' ' 17' ' ' HIS . 21.3 tp10 -170.68 -131.54 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.288 0.565 . . . . 0.0 110.219 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 17' ' ' HIS . 71.5 m-20 -152.23 176.53 11.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.3 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -72.89 -102.47 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.506 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.406 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.9 mm -64.29 -41.49 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -55.43 -9.23 0.44 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.204 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.406 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -51.88 -42.64 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.513 ' CG ' ' N ' ' A' ' 31' ' ' ASN . 11.6 ptt? -66.05 -54.62 23.56 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.513 ' N ' ' CG ' ' A' ' 30' ' ' MET . 61.6 t-20 -57.3 -55.01 40.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.649 -178.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -56.39 -51.43 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.642 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 58.5 t80 -63.02 -47.16 84.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 38' ' ' VAL . 22.1 t80 -53.4 -43.88 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.864 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -74.73 -28.32 60.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.827 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 p -64.51 -44.91 89.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.43 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.1 t -72.01 -54.18 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 34' ' ' TYR . 94.3 t -48.53 -47.01 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 -179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.7 t -56.65 -46.94 80.77 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.277 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.4 m -64.57 -45.4 87.2 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.41 0.624 . . . . 0.0 111.272 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.06 -37.83 88.83 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.726 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 42' ' ' VAL . 48.5 t -92.9 25.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.695 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -147.49 -0.89 0.64 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.45 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 46' ' ' LEU . 73.4 m-20 -145.41 170.83 15.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.309 0.576 . . . . 0.0 110.288 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 62.35 -71.56 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.428 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' ASP . 15.8 mt 44.53 70.45 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.277 0.561 . . . . 0.0 110.604 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -109.53 -31.12 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.439 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -171.6 129.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.65 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -49.15 -38.8 26.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.513 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.8 76.92 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.847 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.6 t -54.48 -55.14 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.418 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.415 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.7 m -64.64 -40.71 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.257 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.415 ' N ' HG23 ' A' ' 52' ' ' VAL . 66.0 tp -60.96 -43.1 99.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.359 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 51.1 mtpt -56.66 -41.19 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.08 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -64.41 -39.9 94.75 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 89.9 mt -69.09 -51.92 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -55.42 -38.44 68.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.143 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 5.5 m-70 -73.36 -22.62 60.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -63.02 -34.24 77.14 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 41.0 p-10 -47.2 -25.48 0.93 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.013 0.435 . . . . 0.0 110.381 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.451 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 12.6 pt-20 -58.76 -40.1 82.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.331 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.93 -58.05 4.67 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.395 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -46.19 -43.51 15.31 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.139 0.495 . . . . 0.0 110.076 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.98 -44.69 88.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.696 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -62.64 -39.31 93.46 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.915 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.17 -47.19 91.04 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.67 0 CA-C-O 121.855 0.836 . . . . 0.0 109.929 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -65.13 -43.74 90.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.353 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -74.33 -5.04 39.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.096 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.603 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -106.12 -77.57 1.11 Allowed Glycine 0 N--CA 1.46 0.291 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.603 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 pt-20 . . . . . 0 N--CA 1.494 1.764 0 CA-C-N 115.529 -0.335 . . . . 0.0 111.637 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.539 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.76 -42.33 87.01 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.601 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 51.5 Cg_exo -54.07 -23.64 29.57 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 121.476 1.45 . . . . 0.0 112.094 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -67.01 -39.41 87.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.628 0.252 . . . . 0.0 110.573 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.407 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.37 -40.23 90.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.102 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . 0.45 ' O ' ' N ' ' B' ' 14' ' ' LEU . 96.8 mt -68.13 -45.66 82.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.512 0.672 . . . . 0.0 110.796 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -47.76 -25.16 1.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.327 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -73.94 -35.37 64.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.053 0.454 . . . . 0.0 110.166 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 11' ' ' ILE . 29.4 mt -70.89 -39.61 72.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.658 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -57.57 -35.55 70.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.099 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -71.33 -28.91 64.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.632 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 52.0 m170 -67.38 -49.88 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.66 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.86 -43.5 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -59.7 -51.55 69.32 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.373 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 52.1 mtm -118.73 -145.34 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.946 0.403 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -157.49 57.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.344 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 65.2 tp60 -61.11 -45.19 95.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.236 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 t 177.57 69.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -169.73 -133.24 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.402 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -151.01 -166.81 2.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.456 0.646 . . . . 0.0 110.269 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -82.23 -109.46 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.423 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.598 HD11 ' HD2' ' B' ' 67' ' ' LYS . 20.4 tt -65.36 -37.46 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 121.091 0.472 . . . . 0.0 110.552 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -57.37 -22.16 40.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.467 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.98 -33.76 2.16 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.611 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -66.18 -52.75 45.16 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.015 178.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.611 ' N ' ' SD ' ' B' ' 30' ' ' MET . 3.0 t-20 -55.35 -50.97 68.26 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.724 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.4 t -61.29 -48.34 81.85 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.407 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 60.0 t80 -70.25 -20.74 63.05 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 40.2 t80 -73.09 -53.1 11.91 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.297 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -68.83 -23.0 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.495 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -70.0 -47.61 61.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.581 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 66.8 t -70.13 -57.9 6.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.106 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.428 ' O ' HG12 ' B' ' 42' ' ' VAL . 76.8 t -48.57 -44.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.428 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 52.8 m -58.49 -34.21 70.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.842 0.353 . . . . 0.0 110.434 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.0 m -82.25 -45.96 14.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.759 0.79 . . . . 0.0 111.372 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.463 ' CD1' ' CZ ' ' B' ' 55' ' ' ARG . 3.2 mm? -64.21 -43.55 94.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.619 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 38' ' ' VAL . 4.3 p -68.17 -20.4 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.054 0.455 . . . . 0.0 109.981 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -98.84 -15.6 19.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -55.64 -47.73 76.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -174.8 126.67 0.29 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 110.565 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 25.0 mt -97.31 39.14 1.2 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.258 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -63.69 -25.35 68.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.684 0.754 . . . . 0.0 110.322 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.727 ' O ' HG22 ' B' ' 51' ' ' VAL . 34.5 tptt -169.41 115.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.826 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 48.4 p30 -50.21 -14.29 0.15 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.174 -0.61 . . . . 0.0 110.985 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.473 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -78.31 -55.1 5.51 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 119.905 -0.718 . . . . 0.0 112.292 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.727 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.3 m -48.35 -37.97 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.837 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -76.35 -33.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.588 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.438 HD13 ' O ' ' B' ' 53' ' ' LEU . 0.2 OUTLIER -62.41 -38.33 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.363 -178.671 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -67.58 -47.15 70.57 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.338 0.59 . . . . 0.0 110.298 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.463 ' CZ ' ' CD1' ' B' ' 41' ' ' LEU . 54.8 mtp180 -61.8 -42.89 99.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.2 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.31 -45.02 94.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.218 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -52.11 -37.78 55.28 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.2 -33.84 76.24 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.02 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.6 ' O ' HD13 ' B' ' 59' ' ' LEU . 0.3 OUTLIER -58.45 -40.82 83.66 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.386 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -51.86 -27.25 12.07 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.961 0.41 . . . . 0.0 110.095 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.31 -40.94 98.73 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.34 -53.54 12.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.834 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.39 -43.05 44.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.058 0.456 . . . . 0.0 109.961 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -64.53 -34.77 79.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.137 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -63.68 -34.37 77.71 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.418 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 99.7 t -65.94 -43.0 92.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 122.058 0.932 . . . . 0.0 110.383 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.598 ' HD2' HD11 ' B' ' 27' ' ' ILE . 19.2 mmmt -66.74 -46.01 76.8 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.207 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -76.24 -19.23 58.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.29 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.98 -33.72 9.46 Favored Glycine 0 N--CA 1.471 1.017 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.4 . . . . 0.0 110.265 -179.877 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.452 -0.371 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.515 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -60.08 -44.8 97.41 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.007 179.453 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 77.3 Cg_exo -48.58 -22.68 4.56 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.645 1.564 . . . . 0.0 112.169 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -73.6 -27.2 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.519 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' O ' ' CD1' ' A' ' 14' ' ' LEU . 1.0 OUTLIER -82.96 -30.38 28.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.135 179.663 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mt -74.05 -52.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 121.691 0.758 . . . . 0.0 111.189 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -52.12 -21.68 3.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.397 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -67.94 -37.18 81.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.684 ' N ' HD12 ' A' ' 14' ' ' LEU . 6.4 mp -69.97 -38.18 76.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.118 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.91 -36.7 72.83 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.883 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.56 -27.12 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -70.48 -53.34 16.68 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.983 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.0 pt -71.43 -40.43 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.088 0.47 . . . . 0.0 110.586 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -65.3 -53.08 49.22 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.889 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . 0.412 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 40.9 mtt -100.16 -65.22 0.98 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.095 0.474 . . . . 0.0 110.33 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 20' ' ' MET . 19.6 t30 79.02 43.58 0.07 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.933 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -55.41 -44.94 76.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.054 0.454 . . . . 0.0 110.491 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.3 p -150.75 67.37 0.94 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.632 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -166.9 -137.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.536 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -148.22 -163.6 1.82 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.159 0.504 . . . . 0.0 110.354 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.473 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.0 tttm -85.91 -109.89 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.1 mt -62.25 -40.95 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -54.94 -21.35 11.44 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.539 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.18 -39.86 30.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.25 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.583 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.2 -46.1 88.59 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.571 179.171 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.583 ' N ' ' SD ' ' A' ' 30' ' ' MET . 9.8 t-20 -55.89 -47.89 76.59 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.658 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.8 p -65.63 -53.39 42.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.804 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE2' HD11 ' A' ' 14' ' ' LEU . 73.3 t80 -62.14 -47.29 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.689 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 30' ' ' MET . 48.2 t80 -57.51 -48.48 79.16 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.697 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.615 ' NH2' ' CD2' ' B' ' 63' ' ' TYR . 6.4 tpt180 -64.32 -30.62 71.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.797 0.332 . . . . 0.0 110.36 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.8 t -69.93 -43.02 72.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.15 -63.15 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.769 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.517 HG23 ' N ' ' A' ' 39' ' ' SER . 30.9 m -47.21 -42.15 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.678 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG23 ' A' ' 38' ' ' VAL . 58.4 m -56.13 -40.36 73.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.828 0.346 . . . . 0.0 110.242 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -71.89 -43.3 65.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.702 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.402 HD22 ' HD2' ' A' ' 55' ' ' ARG . 90.8 mt -62.71 -46.16 89.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.361 -179.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 92.8 t -65.67 -33.1 61.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.096 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -78.9 -18.3 54.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.26 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.938 ' O ' ' O ' ' A' ' 45' ' ' GLN . 42.8 t0 -65.88 169.14 6.98 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 121.217 0.532 . . . . 0.0 109.711 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.938 ' O ' ' O ' ' A' ' 44' ' ' ASP . 14.5 pt20 -13.12 -131.64 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.698 0 CA-C-O 118.51 -0.757 . . . . 0.0 112.684 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 173.75 35.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 118.379 0.536 . . . . 0.0 110.066 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.485 ' HB ' HG21 ' A' ' 51' ' ' VAL . 2.6 m -47.32 -49.58 23.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.209 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.717 ' O ' HG22 ' A' ' 51' ' ' VAL . 16.0 tptp -169.84 134.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.433 HD22 ' CB ' ' B' ' 50' ' ' ALA . 97.6 m-20 -48.98 -16.04 0.12 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.421 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.467 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -78.44 -54.82 5.76 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.489 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 48' ' ' LYS . 23.9 m -49.99 -39.29 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.534 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.3 m -77.5 -40.27 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.171 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.1 -37.61 87.89 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.81 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.452 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 93.3 mttt -58.83 -42.16 88.61 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.163 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.402 ' HD2' HD22 ' A' ' 41' ' ' LEU . 40.6 ttm180 -70.63 -40.94 72.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.442 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.41 -50.37 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.427 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -57.0 -38.55 73.25 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -69.0 -38.7 79.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.735 0.303 . . . . 0.0 110.355 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.48 -24.93 14.39 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.62 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 15.2 p-10 -51.56 -28.36 13.64 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.469 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.452 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 9.1 pt-20 -63.47 -31.9 73.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.504 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.66 -60.12 2.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.505 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -39.7 60.58 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.089 0.471 . . . . 0.0 110.415 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.1 -38.82 91.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.481 -178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.3 mmtt -63.35 -33.02 74.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.319 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.58 -46.25 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.523 0.678 . . . . 0.0 110.509 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HZ3' ' HB3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -66.83 -43.19 84.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.471 -179.363 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -87.3 2.63 49.64 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.035 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.08 -38.55 1.13 Allowed Glycine 0 N--CA 1.478 1.473 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.473 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 pp20? . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 120.708 0.29 . . . . 0.0 110.273 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.514 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.86 -44.23 94.18 Favored Pre-proline 0 CA--C 1.543 0.685 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.957 179.42 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.7 Cg_exo -50.03 -21.68 6.72 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 121.703 1.602 . . . . 0.0 112.21 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.94 -42.73 94.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.922 0.391 . . . . 0.0 110.497 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.451 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.9 m-85 -60.8 -43.47 98.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.291 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.37 -43.53 97.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.262 0.553 . . . . 0.0 110.472 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -51.34 -28.39 12.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.501 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.44 -35.7 73.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.212 0.529 . . . . 0.0 110.575 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 37.9 mt -67.68 -38.33 83.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.462 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -56.49 -40.77 75.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 20' ' ' MET . 55.5 tt0 -66.56 -34.86 78.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.323 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -64.0 -51.68 63.11 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.754 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.599 HD11 ' OE2' ' B' ' 70' ' ' GLU . 11.0 pt -73.13 -40.9 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.111 0.481 . . . . 0.0 110.71 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -72.03 -52.51 16.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.773 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.431 ' N ' ' O ' ' B' ' 16' ' ' GLN . 15.3 tpp -87.05 -63.84 1.24 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.16 0.505 . . . . 0.0 110.45 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 69.85 40.77 1.26 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.92 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -53.56 -35.2 60.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.058 0.456 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -165.59 64.44 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.657 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -158.6 -132.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.333 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -153.05 -176.27 5.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.548 0.689 . . . . 0.0 110.081 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -80.81 -105.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.561 ' O ' ' SD ' ' B' ' 30' ' ' MET . 5.3 mm -60.33 -39.84 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -69.21 18.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.096 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.82 -49.51 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.381 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.561 ' SD ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -56.31 -38.01 70.7 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.386 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.54 ' N ' ' SD ' ' B' ' 30' ' ' MET . 58.5 t-20 -50.69 -44.11 57.83 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.321 -178.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.7 t -74.46 -54.97 6.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.719 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.451 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 88.2 t80 -59.04 -49.8 76.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.535 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.539 ' N ' ' O ' ' B' ' 30' ' ' MET . 22.7 t80 -55.31 -45.47 76.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -63.98 -33.86 76.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 34.3 t -68.56 -45.08 73.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.503 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' B' ' 41' ' ' LEU . 88.4 t -67.95 -62.7 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.305 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.52 HG13 ' N ' ' B' ' 39' ' ' SER . 8.0 p -48.17 -44.39 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.607 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.52 ' N ' HG13 ' B' ' 38' ' ' VAL . 50.8 p -57.82 -57.9 10.73 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.054 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.3 m -73.59 -43.19 60.34 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 122.39 1.09 . . . . 0.0 111.287 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' B' ' 37' ' ' VAL . 41.8 tp -54.14 -41.57 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.37 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -80.46 -16.55 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -83.21 -17.09 43.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.465 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.507 ' CG ' ' H ' ' B' ' 45' ' ' GLN . 24.5 t0 -104.75 -151.87 0.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.103 0.477 . . . . 0.0 109.715 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.507 ' H ' ' CG ' ' B' ' 44' ' ' ASP . 73.5 tp60 31.9 -93.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.152 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ASP . 10.3 mt 54.37 75.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.178 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -136.27 -25.54 1.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.579 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -165.06 128.78 2.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -49.48 -33.57 14.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.475 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.433 ' CB ' HD22 ' A' ' 49' ' ' ASN . . . -71.63 -49.98 35.03 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.021 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 t -50.58 -45.2 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.379 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.5 -35.88 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.804 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 55.3 tp -62.58 -39.79 94.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.486 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.476 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 93.9 mttt -58.41 -43.01 88.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.23 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -68.74 -40.61 79.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.2 -51.38 73.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -54.23 -39.15 66.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.212 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 32.2 m170 -67.54 -35.05 78.31 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.264 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.512 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.8 OUTLIER -60.99 -37.65 83.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.254 -179.298 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -55.77 -32.71 63.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.417 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -58.96 -35.12 72.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.503 . . . . 0.0 110.453 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.62 19.03 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.85 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.615 ' CD2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -52.1 -50.14 62.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.302 0.572 . . . . 0.0 109.746 -179.537 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.4 t30 -62.44 -32.07 72.88 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.377 -178.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -60.57 -36.76 79.3 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.228 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 59.3 t -64.39 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 123.333 1.54 . . . . 0.0 110.863 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.603 ' C ' ' H ' ' B' ' 69' ' ' GLY . 7.2 mmmt -72.31 -30.67 65.0 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 113.637 -1.619 . . . . 0.0 111.496 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 49.2 ttt85 -55.02 1.06 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.608 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . 0.603 ' H ' ' C ' ' B' ' 67' ' ' LYS . . . 97.19 18.53 28.68 Favored Glycine 0 N--CA 1.46 0.235 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.599 ' OE2' HD11 ' B' ' 18' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 121.499 0.666 . . . . 0.0 110.145 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 120.689 0.28 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.578 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -68.78 -40.18 16.61 Favored Pre-proline 0 CA--C 1.539 0.549 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.578 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 78.4 Cg_exo -52.08 -27.18 28.2 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 121.731 1.62 . . . . 0.0 111.883 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -61.71 -41.76 98.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -58.15 -39.04 77.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.053 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.634 HG21 ' HD3' ' A' ' 65' ' ' LYS . 54.6 mt -69.8 -45.91 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-O 121.451 0.644 . . . . 0.0 110.507 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -49.11 -24.09 1.5 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.806 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -74.92 -30.04 61.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.544 0.688 . . . . 0.0 110.695 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.426 HD21 ' CG ' ' A' ' 33' ' ' TYR . 25.1 mt -70.04 -39.5 75.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.601 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -51.22 -39.21 56.08 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.258 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -67.29 -36.52 81.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.406 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.62 -51.42 68.58 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.665 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' A' ' 19' ' ' GLU . 15.2 pt -73.84 -43.77 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.267 0.556 . . . . 0.0 110.958 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' A' ' 18' ' ' ILE . 83.8 tt0 -65.55 -54.3 30.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.672 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.5 mtt -101.03 -160.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 109.861 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -151.82 47.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.96 -49.05 74.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.0 p -176.2 65.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.404 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 12.4 tp10 -163.06 -137.02 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.98 0.419 . . . . 0.0 110.203 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -157.79 -166.96 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 110.16 -179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -81.81 -103.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.56 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.551 ' C ' ' H ' ' A' ' 29' ' ' ALA . 4.8 tt -65.12 -36.25 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.509 -179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 83.8 t60 -65.65 11.25 0.07 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.678 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.551 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -80.36 -44.39 19.52 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.921 0.391 . . . . 0.0 110.653 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.493 ' O ' ' N ' ' A' ' 34' ' ' TYR . 12.3 ptt? -58.8 -47.9 83.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.164 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' ' CG ' ' A' ' 30' ' ' MET . 12.2 m120 -53.06 -53.91 43.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.809 -178.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.42 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 73.3 m -57.99 -51.25 70.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.512 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CE1' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -64.64 -25.52 67.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.124 179.274 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.493 ' N ' ' O ' ' A' ' 30' ' ' MET . 53.9 t80 -71.64 -55.43 7.76 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.054 0.454 . . . . 0.0 110.358 -178.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -65.98 -24.71 66.84 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.454 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -67.23 -51.61 51.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.69 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.45 -55.42 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.6 t -49.48 -53.32 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.662 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -50.35 -56.68 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.842 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 44' ' ' ASP . 18.9 m -61.51 -42.9 99.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.208 0.528 . . . . 0.0 110.521 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.771 HD21 HH11 ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.96 -44.4 94.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.409 -178.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 82.6 t -73.55 -40.0 54.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.027 0.442 . . . . 0.0 110.276 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -73.01 -21.39 60.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.708 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.595 ' CG ' ' H ' ' A' ' 45' ' ' GLN . 26.7 t70 -101.36 -152.07 0.43 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.097 0.475 . . . . 0.0 110.008 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.595 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 5.9 tp-100 30.42 -91.97 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.412 0.625 . . . . 0.0 111.425 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 44' ' ' ASP . 7.3 mt 56.74 101.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.041 178.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.519 HG22 HG21 ' A' ' 51' ' ' VAL . 12.1 t -168.29 -28.13 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.897 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.817 ' O ' HG22 ' A' ' 51' ' ' VAL . 38.1 tptt -164.15 129.38 2.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.87 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.52 -18.1 1.01 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.989 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -75.9 -57.04 4.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.869 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.817 HG22 ' O ' ' A' ' 48' ' ' LYS . 28.7 m -46.64 -36.31 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.755 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 51' ' ' VAL . 34.1 m -81.72 -33.76 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 178.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 39.4 tp -57.3 -55.86 29.34 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.444 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 18.9 ptmt -52.62 -42.55 64.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.317 0.58 . . . . 0.0 110.291 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.771 HH11 HD21 ' A' ' 41' ' ' LEU . 25.8 mmt85 -61.14 -40.95 95.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.753 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.1 mm -69.68 -49.57 57.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.312 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -56.02 -46.08 78.92 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.495 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -66.98 -45.32 78.0 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.245 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.578 HD11 ' CE1' ' A' ' 33' ' ' TYR . 38.8 tp -50.2 -24.86 3.09 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.794 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -62.93 -32.99 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.241 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -62.34 -39.55 93.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.715 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -58.29 5.71 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.571 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -54.05 -42.07 68.82 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 109.877 -179.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.418 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 59.8 t-20 -66.02 -40.87 91.44 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.588 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.634 ' HD3' HG21 ' A' ' 11' ' ' ILE . 62.7 tttm -61.49 -39.59 91.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.44 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.0 t -53.55 -59.88 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.454 -179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.407 ' C ' ' N ' ' A' ' 69' ' ' GLY . 32.0 mtmt -62.45 -46.42 88.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.977 0.894 . . . . 0.0 111.437 -179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -52.11 -15.67 0.62 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.052 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.407 ' N ' ' C ' ' A' ' 67' ' ' LYS . . . -101.16 -13.76 32.67 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 N--CA 1.466 0.352 0 CA-C-O 120.648 0.261 . . . . 0.0 110.369 -179.795 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . 0.504 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.3 p . . . . . 0 N--CA 1.456 -0.132 0 CA-C-O 119.194 -0.431 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.476 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 3.5 t -35.25 -54.67 1.12 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.076 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 19.3 Cg_endo -53.37 -22.24 20.24 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 121.366 1.377 . . . . 0.0 112.44 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' B' ' 6' ' ' SER . 12.4 t80 -66.98 -44.76 79.6 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.769 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.1 m-85 -71.66 -46.42 58.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.759 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 40.1 mt -61.14 -44.83 99.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.275 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -49.8 -31.39 11.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.231 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . 0.465 ' ND2' ' NE2' ' B' ' 17' ' ' HIS . 5.4 t-20 -71.38 -43.44 66.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.386 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' B' ' 33' ' ' TYR . 46.2 mt -62.67 -39.09 92.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.244 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.258 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -75.2 -28.22 59.92 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.014 0.435 . . . . 0.0 110.696 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.465 ' NE2' ' ND2' ' B' ' 13' ' ' ASN . 34.7 m170 -65.43 -51.49 59.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' B' ' 19' ' ' GLU . 3.7 pt -73.08 -44.55 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.085 0.469 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' B' ' 18' ' ' ILE . 72.0 mm-40 -67.48 -50.43 59.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.129 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.0 tpp -94.0 -152.81 0.35 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.538 0.685 . . . . 0.0 109.98 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.97 41.92 0.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.003 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -55.25 -50.5 69.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.237 0.541 . . . . 0.0 110.491 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 36.7 p -174.62 65.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.289 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -162.86 -146.9 0.11 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.913 0.387 . . . . 0.0 110.403 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -144.44 -163.41 1.68 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.113 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -81.54 -108.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.5 mt -64.72 -42.26 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -50.16 -28.79 7.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.82 -31.67 1.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.728 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -65.82 -50.69 63.71 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.355 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' B' ' 30' ' ' MET . 10.8 t30 -57.56 -56.73 18.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.964 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 63.7 p -54.54 -45.57 73.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 76.3 t80 -70.15 -34.53 73.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.538 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' B' ' 30' ' ' MET . 25.3 t80 -61.65 -47.81 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.612 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.482 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.7 mpt_? -69.51 -26.48 64.55 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -68.68 -46.38 69.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.8 t -64.89 -66.12 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.544 -0.863 . . . . 0.0 110.835 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.491 HG23 ' N ' ' B' ' 39' ' ' SER . 25.1 m -44.6 -39.82 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.577 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.491 ' N ' HG23 ' B' ' 38' ' ' VAL . 11.0 t -60.73 -44.93 96.02 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.142 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.7 m -69.67 -46.47 66.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 0.0 110.998 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.413 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -60.28 -33.74 72.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.46 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -87.63 -37.58 10.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -73.12 -14.97 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.672 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' B' ' 41' ' ' LEU . 33.6 t70 -143.67 160.52 40.55 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.484 0.659 . . . . 0.0 110.051 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 41.25 63.35 1.25 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.083 -179.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.87 42.11 1.68 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.56 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . 0.493 HG22 HG21 ' B' ' 51' ' ' VAL . 9.1 t -54.92 -44.01 73.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.764 0.792 . . . . 0.0 110.455 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.809 ' O ' HG22 ' B' ' 51' ' ' VAL . 38.2 tptt -146.81 127.44 14.22 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.881 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -50.19 -15.03 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.939 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.409 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -77.08 -55.79 5.14 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.596 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.809 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.2 m -48.08 -38.0 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.773 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.68 -34.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.144 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.14 -42.25 90.24 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.427 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -56.29 -43.81 79.23 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.018 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.29 -45.06 93.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.93 -52.04 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.786 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -55.32 -41.39 72.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.391 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.21 -38.83 63.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.331 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 5.8 tt -52.63 -26.2 12.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.082 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -52.43 -28.59 20.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.438 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.46 -32.85 74.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.91 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.75 -62.92 1.21 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.748 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.49 -38.97 14.87 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -65.07 -38.55 91.15 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.128 0.49 . . . . 0.0 110.071 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.2 tptp -63.33 -33.07 74.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.179 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 60.6 t -62.57 -46.75 95.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.928 0.87 . . . . 0.0 110.466 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -71.52 -43.0 67.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.203 1.001 . . . . 0.0 112.011 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 29.6 mmm-85 -79.09 -14.14 59.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.478 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -95.88 -42.12 3.65 Favored Glycine 0 N--CA 1.469 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.802 0.334 . . . . 0.0 110.329 -179.934 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.451 -0.398 0 CA-C-O 121.22 0.533 . . . . 0.0 110.352 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.528 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -52.42 -50.25 80.97 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.143 179.07 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 58.1 Cg_exo -41.59 -27.64 0.53 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 121.845 1.697 . . . . 0.0 112.32 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -60.48 -39.43 87.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 110.205 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.412 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.8 m-85 -58.05 -47.05 84.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -66.1 -47.14 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.465 0.65 . . . . 0.0 110.62 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -50.61 -28.55 8.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.62 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -72.36 -37.78 68.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.37 0.605 . . . . 0.0 110.648 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 14.3 mt -67.53 -35.19 78.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.163 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -52.16 -41.85 62.92 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.34 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -68.01 -36.46 80.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.834 0.35 . . . . 0.0 110.675 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.1 -49.3 78.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.721 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.451 HG13 ' N ' ' A' ' 19' ' ' GLU . 27.0 pt -73.24 -41.43 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.783 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.451 ' N ' HG13 ' A' ' 18' ' ' ILE . 47.6 tp10 -55.06 -53.98 48.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.311 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 17.9 ptp -121.25 -134.59 0.31 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.241 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -159.88 53.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.159 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -55.7 -46.41 77.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.3 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.0 p -175.42 57.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -164.71 -139.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.285 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -147.86 -166.3 2.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.349 0.595 . . . . 0.0 110.54 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.5 -105.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.471 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.5 HG23 ' N ' ' A' ' 28' ' ' HIS . 17.4 tt -63.96 -41.83 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.163 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.5 ' N ' HG23 ' A' ' 27' ' ' ILE . 95.5 m-70 -55.65 -11.58 0.97 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.592 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.84 -42.83 48.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.593 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.1 ptm -65.98 -54.76 22.03 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.194 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 30' ' ' MET . 19.0 t-20 -51.61 -47.83 63.48 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.495 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.9 t -68.31 -54.54 16.72 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.648 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.412 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 42.8 t80 -60.63 -48.97 79.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.642 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.739 ' O ' HG23 ' A' ' 38' ' ' VAL . 66.3 t80 -51.88 -43.27 63.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.791 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.6 ttm-85 -77.16 -26.58 53.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.0 m -64.79 -46.83 80.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.771 -179.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.526 HG23 ' N ' ' A' ' 38' ' ' VAL . 26.6 m -76.23 -44.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 34' ' ' TYR . 24.6 t -46.61 -43.33 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.207 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.0 p -58.61 -35.09 71.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.029 0.443 . . . . 0.0 110.506 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 44' ' ' ASP . 95.6 m -85.82 -45.22 11.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.723 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' C ' ' H ' ' A' ' 43' ' ' GLN . 4.4 mm? -63.21 -45.73 90.31 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.039 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 38' ' ' VAL . 2.8 p -68.67 3.99 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.294 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 41' ' ' LEU . 57.1 tt0 -129.28 -23.34 2.98 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.255 -179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 40' ' ' THR . 23.4 t0 -57.79 121.88 11.54 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.25 0.548 . . . . 0.0 110.035 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.452 ' C ' ' O ' ' A' ' 44' ' ' ASP . 11.2 pt20 31.58 89.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.281 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.23 45.71 0.47 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.393 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -59.17 -31.37 68.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.388 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 5.8 ttmt -165.79 131.21 2.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.228 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -50.04 -32.1 14.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.404 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.508 ' N ' HD22 ' B' ' 49' ' ' ASN . . . -72.42 -48.72 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.386 0.612 . . . . 0.0 110.601 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.1 t -49.13 -42.42 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.751 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.402 ' H ' HG22 ' A' ' 52' ' ' VAL . 25.6 m -75.44 -36.36 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.209 0.528 . . . . 0.0 110.295 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -35.82 82.19 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.471 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 59.3 mttp -53.26 -41.98 66.04 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.301 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -65.26 -36.66 84.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.321 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 41.2 mm -66.84 -51.67 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.738 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 77.6 mt-30 -55.37 -40.26 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.348 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.471 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 38.1 m80 -75.73 -40.05 56.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.546 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.4 HD23 ' CE1' ' A' ' 34' ' ' TYR . 62.2 tp -51.51 -30.89 21.87 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.742 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 11.6 p-10 -52.88 -28.4 22.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.38 0.609 . . . . 0.0 110.624 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.549 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.7 pt-20 -57.93 -36.66 72.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.366 -179.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -71.6 -53.82 12.47 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.4 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.441 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.95 -41.36 33.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.208 -179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.441 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 39.5 m-80 -68.09 -41.64 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -65.53 -34.81 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.433 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 62' ' ' ALA . 89.7 t -60.78 -62.31 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.513 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -60.71 -51.86 67.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.349 -0.54 . . . . 0.0 111.148 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 -55.43 -11.86 0.95 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.179 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.83 -28.41 6.62 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.693 0.282 . . . . 0.0 110.638 179.792 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.451 -0.411 0 CA-C-O 120.695 0.283 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.713 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 25.3 t -58.81 -48.58 96.56 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.257 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.713 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 7.4 Cg_endo -47.5 -25.76 5.55 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.969 1.779 . . . . 0.0 112.077 -179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.45 -41.23 98.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.217 0.532 . . . . 0.0 110.449 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.434 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.5 m-85 -59.36 -40.65 87.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.253 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.3 mt -70.04 -43.47 79.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.306 0.574 . . . . 0.0 110.501 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -50.63 -28.78 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.542 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -73.25 -33.28 65.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.034 0.445 . . . . 0.0 110.483 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.431 HD13 ' CG2' ' B' ' 66' ' ' VAL . 25.7 mt -72.0 -38.95 69.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.545 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -56.74 -38.61 72.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.191 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.435 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.7 tt0 -66.98 -35.81 80.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.533 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -63.22 -51.86 64.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.949 0.404 . . . . 0.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.438 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.8 pt -72.53 -44.42 61.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.787 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . 0.438 ' N ' HG13 ' B' ' 18' ' ' ILE . 83.2 tt0 -68.85 -53.98 18.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.435 ' N ' ' O ' ' B' ' 16' ' ' GLN . 11.2 tpp -86.75 -153.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.196 0.522 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -162.27 36.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.515 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -46.06 -63.16 1.05 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.995 0.426 . . . . 0.0 110.637 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -172.41 65.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.48 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 19.1 tp10 -154.92 -131.33 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.025 0.44 . . . . 0.0 110.359 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -160.37 -173.86 4.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.343 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -74.35 -106.36 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.604 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.562 ' C ' ' H ' ' B' ' 29' ' ' ALA . 19.0 mt -66.0 -33.49 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -64.01 8.67 0.09 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.859 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . 0.562 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.46 -43.56 31.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.742 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.417 ' CG ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -58.82 -46.86 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.058 -179.749 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -51.99 -48.75 64.27 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.393 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 65.7 p -67.78 -55.68 12.13 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.907 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.622 ' CE2' HG21 ' B' ' 37' ' ' VAL . 86.2 t80 -56.78 -47.49 80.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.596 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -58.16 -44.2 87.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.936 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -61.97 -35.46 78.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.281 0.563 . . . . 0.0 110.788 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.2 p -73.92 -44.25 55.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.66 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.622 HG21 ' CE2' ' B' ' 33' ' ' TYR . 50.0 t -69.96 -57.1 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.619 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.475 HG13 ' N ' ' B' ' 39' ' ' SER . 5.8 p -48.61 -41.52 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.033 0.444 . . . . 0.0 110.396 -179.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.475 ' N ' HG13 ' B' ' 38' ' ' VAL . 42.6 t -64.67 -38.17 90.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.265 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 44' ' ' ASP . 89.0 m -71.95 -44.06 64.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.385 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.66 -44.04 80.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -73.37 -32.4 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -77.65 -35.11 52.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.218 0.532 . . . . 0.0 110.61 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 40' ' ' THR . 98.8 m-20 -39.12 -68.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -174.53 139.67 0.58 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.556 ' N ' HD12 ' B' ' 46' ' ' LEU . 9.5 mp -96.04 48.32 1.11 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.341 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -61.56 -36.01 79.4 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.004 0.43 . . . . 0.0 110.6 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.527 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -166.61 128.48 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.62 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 24.4 p30 -47.91 -34.65 9.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.572 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.527 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -65.79 -49.59 67.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.007 0.432 . . . . 0.0 110.813 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' B' ' 54' ' ' LYS . 22.4 t -50.96 -43.98 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.71 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.2 m -80.68 -37.28 16.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.119 0.485 . . . . 0.0 110.65 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.15 -47.34 83.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.938 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.461 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.7 pttp -54.16 -41.29 68.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.579 0.704 . . . . 0.0 110.27 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.461 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 27.2 mmt180 -65.35 -37.91 88.48 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.136 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 6.0 mm -66.17 -48.56 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.684 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -56.18 -41.86 76.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.405 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -69.17 -38.9 78.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.384 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . 0.548 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.9 OUTLIER -53.83 -36.32 62.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.572 -178.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -53.82 -27.43 29.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.438 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -64.51 -37.95 89.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.452 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.6 -53.65 10.0 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.404 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -51.34 -39.63 57.43 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.056 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . 0.453 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 49.7 t30 -71.02 -38.17 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.251 -178.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 43.0 mmtt -59.66 -32.13 70.19 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.438 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.431 ' CG2' HD13 ' B' ' 14' ' ' LEU . 98.7 t -64.67 -60.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.46 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -67.83 -45.13 75.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.372 0.606 . . . . 0.0 110.985 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -54.55 -23.21 15.68 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.313 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.89 -7.63 70.55 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.29 0.567 . . . . 0.0 110.37 179.8 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 29.8 t . . . . . 0 CA--C 1.532 0.271 0 CA-C-O 120.935 0.398 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.538 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.6 t -51.71 -55.63 28.23 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.6 178.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 28.1 Cg_exo -36.12 -26.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.353 2.035 . . . . 0.0 112.479 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 7' ' ' VAL . 88.4 t80 -60.7 -43.11 98.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.394 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.433 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -56.46 -47.99 78.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.55 -45.09 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.415 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -51.65 -25.19 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.672 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.32 -36.4 74.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 110.48 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.615 ' N ' HD12 ' A' ' 14' ' ' LEU . 8.3 mp -68.41 -37.75 80.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.33 -39.35 86.77 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.259 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -55.23 -26.6 40.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.619 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -73.74 -53.74 9.66 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.849 -179.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -71.54 -42.89 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.493 0.664 . . . . 0.0 110.878 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.439 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 79.4 mm-40 -62.17 -53.03 61.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.179 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.3 mtt -103.05 -141.07 0.36 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.088 0.471 . . . . 0.0 110.081 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -169.84 56.5 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -51.61 63.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.193 0.52 . . . . 0.0 110.613 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 t 179.38 73.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.211 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.447 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 6.3 tp10 -164.6 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.995 0.426 . . . . 0.0 110.397 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -149.66 -172.18 4.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.46 0.648 . . . . 0.0 110.213 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 18' ' ' ILE . 59.7 tttp -79.75 -108.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.615 ' O ' ' SD ' ' A' ' 30' ' ' MET . 20.0 tt -61.52 -37.52 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.422 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.3 m-70 -69.56 20.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.067 0.46 . . . . 0.0 111.018 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.552 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -73.9 -45.91 47.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.615 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -59.66 -38.97 82.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.376 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.56 ' N ' ' SD ' ' A' ' 30' ' ' MET . 18.5 m120 -51.4 -44.96 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.272 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.447 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 6.8 t -73.32 -54.5 8.21 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.813 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.477 ' CD1' HD11 ' A' ' 14' ' ' LEU . 64.7 t80 -59.62 -50.66 73.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.542 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.1 t80 -54.9 -40.8 70.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.818 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.3 ttt-85 -72.33 -27.15 62.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.848 0.356 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -70.59 -44.37 67.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.404 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.518 ' O ' ' N ' ' A' ' 41' ' ' LEU . 59.3 t -66.09 -63.82 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.791 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.212 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 42' ' ' VAL . 26.3 m -47.18 -43.7 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.965 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.546 ' N ' HG23 ' A' ' 38' ' ' VAL . 11.5 t -53.27 -59.1 4.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 m -77.73 -41.55 37.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.993 0.902 . . . . 0.0 111.277 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 37' ' ' VAL . 40.7 tp -55.17 -41.34 71.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 38' ' ' VAL . 55.0 t -68.25 -3.85 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 120.912 0.387 . . . . 0.0 110.173 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.555 ' O ' ' C ' ' A' ' 44' ' ' ASP . 11.3 tp-100 -113.07 -29.56 7.28 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.035 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.555 ' C ' ' O ' ' A' ' 43' ' ' GLN . 46.7 t0 -17.81 -78.92 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.188 0.518 . . . . 0.0 111.341 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.421 ' O ' ' C ' ' A' ' 46' ' ' LEU . 27.5 pt20 -142.89 0.5 1.23 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.554 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' A' ' 45' ' ' GLN . 5.5 tp 34.18 50.39 0.36 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.099 0.476 . . . . 0.0 110.722 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -56.21 -28.49 58.51 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.606 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.529 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 62.2 tttp -178.66 143.92 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.324 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -57.71 -38.82 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.694 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.529 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -68.44 -49.88 56.69 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.75 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 t -51.15 -65.08 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.08 -31.95 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.275 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.52 -42.52 98.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.101 0.476 . . . . 0.0 110.402 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -59.99 -40.28 88.61 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.134 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -66.63 -39.45 88.29 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.317 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.25 -48.88 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.66 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -57.15 -33.02 66.98 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.134 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 4.6 t-80 -74.54 -40.49 61.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.027 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.2 -29.24 63.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.067 0.46 . . . . 0.0 110.532 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -51.38 -30.65 19.63 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.75 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 7.5 pt-20 -60.72 -28.97 69.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.21 -59.67 2.74 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.368 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -42.98 66.71 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.348 0.594 . . . . 0.0 110.218 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -62.69 -39.02 92.66 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.2 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -63.6 -38.53 91.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.502 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.04 -50.89 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-O 121.336 0.588 . . . . 0.0 110.355 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.88 -47.31 78.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.689 0.757 . . . . 0.0 111.304 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -56.16 -18.38 9.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.071 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.44 -18.41 52.62 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 . . . . . 0 C--N 1.33 -0.28 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.938 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.44 -0.963 0 CA-C-O 120.689 0.28 . . . . 0.0 110.482 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 67.1 t -55.37 -49.86 90.07 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.826 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 6.7 Cg_endo -46.7 -20.6 1.1 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.831 1.687 . . . . 0.0 112.296 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -60.17 -42.54 95.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.151 0.501 . . . . 0.0 110.489 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . 0.456 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.5 m-85 -58.52 -41.97 86.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.407 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 64.6 mt -67.65 -44.23 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 121.533 0.682 . . . . 0.0 110.464 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -51.61 -30.61 21.84 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.629 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.53 -32.05 70.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.115 0.483 . . . . 0.0 110.408 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.67 -39.35 70.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.293 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -55.85 -32.1 63.33 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.095 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -69.25 -30.61 68.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.522 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -67.87 -50.54 55.86 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 pt -72.73 -35.86 51.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 110.773 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -70.94 -54.34 11.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.43 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 28.8 ttp -99.03 -62.5 1.23 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.441 HD21 ' HA ' ' B' ' 25' ' ' ASP . 11.1 t-20 78.6 49.81 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.244 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -51.06 -41.34 59.85 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 110.844 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -165.44 65.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.235 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -154.43 -131.97 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.179 0.514 . . . . 0.0 110.405 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . 0.441 ' HA ' HD21 ' B' ' 21' ' ' ASN . 69.1 m-20 -151.93 -175.59 5.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.46 0.648 . . . . 0.0 109.996 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -80.02 -104.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.95 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.641 HD11 ' HD2' ' B' ' 67' ' ' LYS . 15.8 tt -63.11 -37.12 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.243 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -63.13 -3.52 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.477 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.54 -46.52 83.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.407 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -63.96 -43.17 96.59 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.176 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.574 ' N ' ' SD ' ' B' ' 30' ' ' MET . 22.5 t-20 -52.48 -53.65 42.91 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.769 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 8.3 t -64.22 -53.51 48.11 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.823 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.456 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -59.22 -49.44 77.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.459 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.3 t80 -56.92 -47.24 81.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.821 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -65.06 -31.35 72.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.507 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.4 t -68.8 -42.85 76.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.646 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.11 -63.68 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.764 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.556 HG23 ' N ' ' B' ' 39' ' ' SER . 26.7 m -48.83 -44.46 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.41 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . 0.556 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.9 p -60.7 -40.23 91.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.412 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 96.7 m -69.4 -46.76 66.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.121 0.486 . . . . 0.0 110.677 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' B' ' 44' ' ' ASP . 93.3 mt -60.35 -30.06 69.3 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.409 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -89.16 -39.69 12.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.154 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -69.38 -13.66 62.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 45' ' ' GLN . 71.8 m-20 -146.45 166.74 25.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.346 0.593 . . . . 0.0 109.564 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 15.5 tt0 79.22 -77.99 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.71 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 24.6 mt 41.11 37.88 0.64 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.017 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.1 t -72.34 -32.22 66.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.421 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.6 tttt -170.41 132.2 0.98 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.611 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.23 -40.67 59.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.786 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.421 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -62.9 -44.49 95.97 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.824 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.46 -44.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.569 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.462 HG23 ' N ' ' B' ' 53' ' ' LEU . 28.5 m -79.22 -44.96 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.246 0.546 . . . . 0.0 110.683 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.462 ' N ' HG23 ' B' ' 52' ' ' VAL . 58.4 tp -57.06 -57.02 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.823 -178.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 0.2 OUTLIER -50.9 -34.59 29.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.257 0.551 . . . . 0.0 110.502 -179.309 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt85 -71.81 -41.87 67.74 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.978 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.3 -53.42 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.523 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -58.19 -37.8 75.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.473 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 4.4 m-70 -73.41 -38.95 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.38 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 40.7 tp -55.64 -30.11 60.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.567 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -52.33 -28.28 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -59.62 -32.27 70.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.571 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -55.61 7.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.521 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -42.67 62.32 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.265 0.555 . . . . 0.0 110.397 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -63.92 -39.65 94.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.415 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.84 -38.25 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.468 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.8 t -62.14 -47.93 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' B' ' 27' ' ' ILE . 0.0 OUTLIER -66.04 -40.79 91.26 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 122.014 0.911 . . . . 0.0 111.296 -179.278 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -49.8 -25.79 3.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.312 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.84 -20.38 55.93 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' B' ' 67' ' ' LYS . 55.4 mm-40 . . . . . 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 0.0 110.057 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 120.612 0.244 . . . . 0.0 110.64 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.569 ' O ' ' N ' ' A' ' 9' ' ' TYR . 2.6 t -53.69 -55.21 37.77 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.043 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 77.6 Cg_exo -34.94 -25.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.391 2.06 . . . . 0.0 112.933 -179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.569 ' N ' ' O ' ' A' ' 7' ' ' VAL . 82.9 t80 -56.37 -40.16 74.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -61.82 -45.66 92.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.563 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.11 -43.68 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.427 0.632 . . . . 0.0 110.552 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -48.63 -23.74 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.397 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -74.18 -35.33 63.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.172 0.511 . . . . 0.0 110.632 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.1 mt -68.28 -39.41 82.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.574 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -57.88 -40.09 79.43 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.595 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -65.95 -31.04 71.72 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -67.15 -52.39 42.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.093 0.473 . . . . 0.0 110.97 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 11.8 pt -72.82 -42.86 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.576 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 52.1 tp10 -62.07 -54.41 41.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.432 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 44.1 mtt -99.34 -139.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -170.3 49.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.232 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -58.12 -45.52 87.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.494 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 m 174.5 72.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.325 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.76 -136.77 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.115 0.483 . . . . 0.0 110.301 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -145.18 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.307 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -96.18 -108.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.357 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.599 ' O ' ' SD ' ' A' ' 30' ' ' MET . 10.3 tp -55.85 -36.75 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.01 0.433 . . . . 0.0 110.52 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.402 ' N ' HG23 ' A' ' 27' ' ' ILE . 97.3 m-70 -81.42 20.51 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.526 -179.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.72 -52.8 26.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.49 . . . . 0.0 110.754 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.599 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.88 -32.92 72.34 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.249 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.517 ' N ' ' SD ' ' A' ' 30' ' ' MET . 51.3 t30 -51.68 -48.79 63.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.472 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.6 t -67.9 -52.88 31.27 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.744 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -60.67 -48.06 83.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.325 0.583 . . . . 0.0 110.936 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.576 ' CE1' HG21 ' A' ' 38' ' ' VAL . 54.4 t80 -55.18 -54.81 38.64 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.997 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.34 -35.63 76.1 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.438 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.5 t -63.04 -44.64 95.33 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.392 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.83 -56.6 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.5 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.576 HG21 ' CE1' ' A' ' 34' ' ' TYR . 90.5 t -54.79 -49.09 71.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.36 -178.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -60.34 -45.22 94.21 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.307 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 78.3 m -61.13 -48.78 80.03 Favored 'General case' 0 C--N 1.328 -0.37 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.544 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.86 -41.27 91.87 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.15 0.5 . . . . 0.0 110.743 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 42' ' ' VAL . 60.2 t -86.16 26.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.23 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -162.32 10.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -151.15 17.98 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.186 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -147.79 -79.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.669 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.9 mt 48.46 45.75 20.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.856 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -85.61 -27.15 25.64 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.465 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 tptm -173.02 132.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.975 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.44 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 8.5 m120 -51.19 -45.79 61.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.513 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.6 -46.79 88.92 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.968 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.4 t -56.32 -46.3 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.084 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.573 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.3 m -78.48 -49.92 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-O 121.736 0.779 . . . . 0.0 110.333 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.6 ' C ' HD23 ' A' ' 53' ' ' LEU . 9.0 tt -52.77 -59.97 3.83 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.937 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -49.22 -34.77 15.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.342 0.592 . . . . 0.0 110.196 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.2 -38.77 91.5 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.962 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 52' ' ' VAL . 16.3 mm -65.52 -51.03 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.449 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -58.85 -40.7 85.06 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.506 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -72.62 -47.63 46.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.144 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.4 ' N ' ' ND1' ' A' ' 58' ' ' HIS . 37.6 tp -55.89 -33.69 64.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -56.76 -34.7 67.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.151 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.509 ' O ' ' ND2' ' A' ' 64' ' ' ASN . 4.7 pt-20 -52.84 -30.49 33.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.335 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.82 -42.0 35.22 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.553 0.692 . . . . 0.0 110.909 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.1 OUTLIER -56.17 -47.49 78.15 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.163 -179.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.517 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 0.7 OUTLIER -73.4 -22.59 60.21 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.003 0.43 . . . . 0.0 110.199 -179.246 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.22 -47.53 70.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.619 0.723 . . . . 0.0 111.348 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 63' ' ' TYR . 0.8 OUTLIER -56.77 -40.79 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.12 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.429 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 21.1 mtmt -67.86 -45.89 73.27 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.015 0.912 . . . . 0.0 111.127 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.66 -32.24 63.06 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.963 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.83 -14.28 79.9 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 . . . . . 0 N--CA 1.469 0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.42 179.818 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--O 1.232 0.132 0 CA-C-O 121.312 0.577 . . . . 0.0 109.793 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.589 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.2 t -67.01 -39.86 24.95 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.135 178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.589 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 76.7 Cg_exo -50.42 -26.75 16.82 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.89 1.727 . . . . 0.0 112.154 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.6 -40.76 92.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.426 0.631 . . . . 0.0 110.517 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.76 -41.78 87.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.487 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 56.2 mt -67.44 -44.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 CA-C-O 121.292 0.568 . . . . 0.0 110.267 -179.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -49.18 -27.67 3.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.59 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 61.6 t-20 -74.23 -35.11 63.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.593 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -57.29 -40.17 77.22 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.09 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -65.8 -35.91 82.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.282 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . 0.439 ' O ' ' OD1' ' B' ' 21' ' ' ASN . 7.5 m-70 -65.96 -48.74 70.32 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.561 -0.455 . . . . 0.0 110.742 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -74.77 -33.12 30.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.0 110.694 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.19 -56.61 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.073 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' MET . . . . . 0.436 ' C ' ' ND2' ' B' ' 21' ' ' ASN . 47.6 mtt -87.28 -56.27 3.44 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.998 0.428 . . . . 0.0 110.617 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' B' ' 17' ' ' HIS . 3.7 m-80 73.58 46.19 0.22 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.026 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -39.95 -64.54 0.48 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.127 0.489 . . . . 0.0 111.02 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -140.62 3.44 1.88 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.768 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -86.99 -131.85 0.06 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.125 0.488 . . . . 0.0 110.335 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -156.43 -158.13 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.336 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -95.47 -101.87 0.16 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.514 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' ILE . . . . . 0.401 HD11 ' OE1' ' B' ' 70' ' ' GLU . 44.3 mm -62.64 -37.26 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.43 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -69.89 2.55 3.34 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.536 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -50.36 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.038 0.447 . . . . 0.0 111.087 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.562 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.11 -42.61 99.4 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.995 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.562 ' N ' ' SD ' ' B' ' 30' ' ' MET . 44.9 t30 -50.6 -51.52 47.76 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.523 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 70.3 p -63.63 -51.56 64.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.591 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.465 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 43.2 t80 -65.09 -20.4 66.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' TYR . . . . . 0.675 ' O ' HG23 ' B' ' 38' ' ' VAL . 52.9 t80 -72.97 -53.87 10.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.062 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' CZ ' ' A' ' 34' ' ' TYR . 19.7 mmm180 -72.51 -18.32 61.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.821 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.0 t -68.92 -51.64 37.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.947 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' VAL . . . . . 0.527 HG23 ' N ' ' B' ' 38' ' ' VAL . 10.2 m -77.4 -44.72 30.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.675 HG23 ' O ' ' B' ' 34' ' ' TYR . 71.0 t -53.71 -49.45 57.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.382 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 36.8 t -64.44 -25.74 68.14 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.864 0.364 . . . . 0.0 110.348 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' THR . . . . . 0.546 ' O ' ' N ' ' B' ' 44' ' ' ASP . 35.5 m -83.13 -50.52 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.554 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.561 HD22 ' CZ ' ' B' ' 55' ' ' ARG . 96.8 mt -63.02 -42.24 99.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.921 0.391 . . . . 0.0 110.827 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.5 t -68.47 -17.7 22.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.415 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -108.0 -19.25 13.57 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.048 0.451 . . . . 0.0 110.794 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' B' ' 40' ' ' THR . 37.6 t70 -90.5 -25.54 20.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.394 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -117.62 160.56 21.08 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.308 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -168.74 31.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.9 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 69.1 m -67.09 -41.19 86.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 110.902 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.487 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -174.08 142.93 0.88 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.265 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -51.49 -34.85 37.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.741 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' ALA . . . . . 0.487 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -75.51 -50.97 14.08 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.858 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -50.67 -43.23 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.698 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' VAL . . . . . 0.422 HG23 ' N ' ' B' ' 53' ' ' LEU . 23.0 m -75.15 -38.01 41.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.07 0.462 . . . . 0.0 110.285 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' LEU . . . . . 0.422 ' N ' HG23 ' B' ' 52' ' ' VAL . 65.7 tp -57.97 -36.27 72.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.573 -179.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' LYS . . . . . 0.417 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 57.6 mtpt -57.33 -41.57 80.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.549 -179.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' ARG . . . . . 0.561 ' CZ ' HD22 ' B' ' 41' ' ' LEU . 67.6 mtp180 -65.63 -41.36 92.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.117 0.484 . . . . 0.0 110.449 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 21.9 mm -65.33 -50.5 72.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.856 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' GLN . . . . . 0.637 HE22 ' CG1' ' A' ' 42' ' ' VAL . 92.4 mm-40 -57.53 -39.42 76.56 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.311 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 52.8 m170 -65.85 -44.97 83.86 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.161 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.7 tp -53.57 -27.78 28.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.099 0.476 . . . . 0.0 111.016 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -52.52 -36.7 55.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.94 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.78 -31.66 71.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.477 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.98 -58.88 4.09 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.124 0.488 . . . . 0.0 110.813 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -40.19 61.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.353 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -66.66 -39.06 88.03 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.595 0.712 . . . . 0.0 110.319 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.7 mmtp -62.67 -36.8 84.06 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.305 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.4 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 82.2 t -63.8 -42.15 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-O 121.378 0.608 . . . . 0.0 110.264 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -67.18 -45.12 77.92 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.693 0.759 . . . . 0.0 111.488 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 51.7 ttt85 -88.71 1.49 55.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.103 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -108.67 -34.37 2.65 Favored Glycine 0 N--CA 1.474 1.226 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.401 ' OE1' HD11 ' B' ' 27' ' ' ILE . 1.5 pp20? . . . . . 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.549 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 94.5 p -74.21 97.21 2.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.443 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' C ' ' H ' ' A' ' 5' ' ' PHE . 15.6 pt-20 -169.47 142.55 2.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.64 -179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 33.5 mt 58.08 7.78 0.68 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.419 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.437 ' CE2' ' OG ' ' A' ' 6' ' ' SER . 51.2 p90 -68.77 -34.45 75.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.437 ' OG ' ' CE2' ' A' ' 5' ' ' PHE . 0.9 OUTLIER -75.39 132.17 40.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.217 -179.202 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.562 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -67.52 -41.63 32.46 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.278 -0.419 . . . . 0.0 109.943 178.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 59.1 Cg_exo -49.58 -24.84 9.96 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 C-N-CA 121.727 1.618 . . . . 0.0 111.915 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -59.59 -40.92 89.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.022 0.439 . . . . 0.0 110.362 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.424 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.6 m-85 -59.31 -42.38 91.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.232 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.0 mt -65.88 -43.93 92.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.025 0.441 . . . . 0.0 110.421 -179.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -50.84 -29.74 12.56 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.55 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -69.87 -35.73 74.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 110.57 179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.431 HD21 ' CD1' ' A' ' 33' ' ' TYR . 42.2 mt -67.36 -38.53 84.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.693 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 35.6 ttpt -55.91 -36.22 67.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 -69.4 -36.69 76.98 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.5 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 46.9 m170 -60.88 -50.86 71.73 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.631 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.405 HG13 ' N ' ' A' ' 19' ' ' GLU . 14.1 pt -72.07 -43.65 66.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.155 0.502 . . . . 0.0 110.942 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.405 ' N ' HG13 ' A' ' 18' ' ' ILE . 50.5 tp10 -66.53 -51.74 53.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.391 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.1 mtt -104.51 -157.44 0.61 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 0.0 109.856 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.479 ' C ' ' H ' ' A' ' 23' ' ' SER . 61.4 t30 -142.77 62.58 1.4 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.455 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.402 ' O ' ' OG ' ' A' ' 23' ' ' SER . 6.1 tp-100 -73.01 39.82 0.09 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.528 0.68 . . . . 0.0 110.87 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 21' ' ' ASN . 5.0 p 75.76 50.86 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.402 179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.41 ' OE2' ' OG ' ' A' ' 32' ' ' SER . 12.6 tp10 -143.62 -137.72 0.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.718 -179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -151.78 -164.42 1.98 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.373 -179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -84.25 -105.42 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.467 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.435 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.3 mt -62.21 -41.79 92.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.375 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -57.61 -6.03 0.44 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 120.786 -0.365 . . . . 0.0 110.457 -178.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -61.2 -45.12 95.89 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.185 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.6 ' O ' ' N ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -63.42 -45.46 90.85 Favored 'General case' 0 N--CA 1.444 -0.773 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.216 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.587 ' N ' ' SD ' ' A' ' 30' ' ' MET . 55.4 t30 -53.47 -49.72 66.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.047 -0.661 . . . . 0.0 110.65 -178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.41 ' OG ' ' OE2' ' A' ' 24' ' ' GLU . 77.0 p -63.33 -50.39 70.18 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.03 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.431 ' CD1' HD21 ' A' ' 14' ' ' LEU . 48.2 t80 -69.33 -22.07 63.79 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.746 179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 30' ' ' MET . 40.2 t80 -74.81 -56.65 4.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.304 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.7 ptm85 -60.22 -25.25 65.48 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 120.984 0.421 . . . . 0.0 110.325 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 11.8 t -72.31 -45.99 57.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.865 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 22.6 t -66.68 -63.03 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 119.773 -0.771 . . . . 0.0 110.494 -179.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.486 HG23 ' N ' ' A' ' 39' ' ' SER . 20.0 m -46.33 -40.49 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.523 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.486 ' N ' HG23 ' A' ' 38' ' ' VAL . 37.6 m -59.2 -39.64 83.29 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 92.2 m -74.42 -44.56 51.34 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.572 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.446 ' O ' ' OD1' ' A' ' 44' ' ' ASP . 91.0 mt -56.51 -22.93 36.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.604 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 73.8 t -92.32 -28.34 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.594 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -90.37 -38.33 13.4 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.39 0.614 . . . . 0.0 110.813 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.451 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 26.2 p-10 -42.55 -59.4 1.9 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.986 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.438 ' N ' ' OD1' ' A' ' 44' ' ' ASP . 13.3 pt20 -167.76 124.21 1.1 Allowed 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 121.557 0.694 . . . . 0.0 110.395 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 mp -94.7 51.72 1.43 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.378 179.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.8 t -60.37 -31.33 70.24 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.221 0.534 . . . . 0.0 110.374 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.1 tptm -169.65 128.1 0.94 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.702 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.0 p30 -49.31 -33.3 12.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.179 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.429 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -71.93 -49.37 38.23 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.785 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.1 t -46.9 -38.68 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.37 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.7 m -83.21 -34.56 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 121.267 0.556 . . . . 0.0 111.099 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.457 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.82 -46.46 87.84 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.026 -177.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -40.44 94.78 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.008 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.445 ' CZ ' HD22 ' A' ' 41' ' ' LEU . 75.3 mtp180 -65.98 -39.79 90.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.283 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 86.6 mt -66.27 -46.24 87.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.4 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -58.1 -34.95 70.74 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 53.3 m170 -69.82 -42.21 73.97 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.16 -29.49 45.71 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.549 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -52.62 -29.91 28.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.543 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -63.45 -32.95 74.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.142 0.496 . . . . 0.0 110.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.41 -58.1 4.09 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.765 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.529 ' OH ' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -52.02 -43.41 63.69 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 121.117 0.484 . . . . 0.0 110.071 179.866 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -64.29 -33.73 76.49 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.386 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -64.2 -39.22 93.53 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.575 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.25 -51.33 72.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.394 0.616 . . . . 0.0 110.435 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 1.8 mtmt -65.32 -45.97 82.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.842 0.829 . . . . 0.0 111.333 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -54.42 -25.42 24.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.127 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.12 -12.72 82.96 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 110.605 -0.998 . . . . 0.0 110.605 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -87.4 -164.9 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 0.0 110.408 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 90.0 p -148.4 54.11 1.01 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.811 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 68.1 mttm 57.85 22.15 8.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.233 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 32.5 tp -59.86 98.51 0.05 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.353 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -179.14 43.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.438 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 64.22 81.03 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.155 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -54.8 123.42 13.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.001 0.429 . . . . 0.0 110.416 -179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.457 ' O ' ' CG ' ' A' ' 77' ' ' HIS . 53.3 t-80 -84.74 23.53 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.444 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 57.8 t-80 54.39 77.84 0.18 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.625 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 60.2 t-80 -149.96 139.99 22.02 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.682 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 . . . . . 0 C--O 1.221 -0.434 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.532 179.967 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.52 ' SD ' ' N ' ' B' ' 1' ' ' MET . 1.9 mpt? . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 78.2 p -79.0 -54.25 6.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.313 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 50.75 91.43 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.112 0.482 . . . . 0.0 110.601 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.459 ' C ' ' H ' ' B' ' 6' ' ' SER . 1.5 tp -168.91 -158.23 0.2 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.221 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 48.4 t80 68.85 -44.01 0.52 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.648 0.737 . . . . 0.0 110.491 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.459 ' H ' ' C ' ' B' ' 4' ' ' LEU . 1.4 m -64.88 130.77 44.68 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.417 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.621 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 74.4 t -57.49 -49.72 92.23 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.971 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 8.7 Cg_endo -47.44 -23.81 3.66 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.349 1.366 . . . . 0.0 112.279 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -63.62 -42.56 98.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.089 0.471 . . . . 0.0 110.651 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.423 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.71 -43.91 97.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.366 -179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 67.5 mt -69.18 -44.01 81.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.2 0.524 . . . . 0.0 110.569 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -50.72 -26.78 5.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.337 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -72.67 -31.79 65.34 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.893 0.378 . . . . 0.0 110.278 179.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 36.1 mt -71.98 -36.17 69.71 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.529 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -55.82 -39.37 71.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.989 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -65.64 -36.39 83.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.635 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -62.84 -51.41 67.14 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.635 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.6 pt -73.02 -43.2 59.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.087 0.47 . . . . 0.0 110.811 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 80.5 tt0 -64.97 -55.2 20.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.687 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 42.7 mtt -98.05 -145.04 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 50.3 p30 -170.63 46.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.153 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.01 -44.72 74.82 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.554 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 m -179.97 69.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.148 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -165.08 -134.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.32 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 -156.94 -167.44 2.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.346 0.593 . . . . 0.0 110.014 -179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -83.23 -106.07 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.585 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.461 ' C ' ' H ' ' B' ' 29' ' ' ALA . 21.3 tt -63.0 -34.57 67.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -67.59 8.09 0.4 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.779 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.48 -45.25 39.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.036 0.446 . . . . 0.0 110.679 179.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.419 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.6 OUTLIER -60.9 -46.67 89.72 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.834 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -52.79 -46.14 67.49 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.401 -0.52 . . . . 0.0 110.516 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 73.7 m -67.56 -54.17 22.21 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.835 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.423 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -61.76 -46.17 90.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.252 0.548 . . . . 0.0 110.669 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.601 ' O ' HG23 ' B' ' 38' ' ' VAL . 68.5 t80 -55.98 -47.11 78.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.741 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.529 ' NH2' ' OH ' ' A' ' 63' ' ' TYR . 76.0 ttt180 -66.16 -34.22 77.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 20.4 m -62.33 -45.01 95.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.871 0.367 . . . . 0.0 110.649 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 85.5 t -69.26 -44.87 80.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.501 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.601 HG23 ' O ' ' B' ' 34' ' ' TYR . 65.5 t -51.25 -48.19 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.434 -179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 78.4 p -56.39 -43.05 78.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.473 -179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . 0.43 ' O ' ' N ' ' B' ' 44' ' ' ASP . 95.8 m -64.38 -44.62 90.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.674 179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 93.1 mt -60.85 -47.29 87.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.508 -179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 97.9 t -67.11 -40.84 86.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.822 0.344 . . . . 0.0 110.369 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.483 ' O ' ' C ' ' B' ' 44' ' ' ASP . 94.8 mt-30 -72.97 -32.39 65.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.151 0.5 . . . . 0.0 110.655 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.483 ' C ' ' O ' ' B' ' 43' ' ' GLN . 67.0 t0 -28.5 -84.2 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.059 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.147 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.51 ' O ' ' N ' ' B' ' 47' ' ' THR . 26.5 pt20 -162.78 9.76 0.06 Allowed 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 120.493 -0.483 . . . . 0.0 110.47 178.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' B' ' 45' ' ' GLN . 1.1 tt 26.03 42.0 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.031 -178.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.51 ' N ' ' O ' ' B' ' 45' ' ' GLN . 5.2 t -60.05 -33.01 71.47 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.447 -178.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -154.32 127.43 8.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.592 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -47.45 -33.53 6.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.064 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -67.9 -50.22 57.47 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.649 0.261 . . . . 0.0 110.743 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 24.2 t -50.79 -46.46 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.318 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -76.22 -39.93 35.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.378 0.608 . . . . 0.0 111.406 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -66.56 -40.56 89.07 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.896 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.405 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 17.8 mtpp -58.18 -44.87 88.24 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.172 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 83.6 mmt-85 -65.62 -34.94 79.39 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.977 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.2 mm -69.08 -48.19 70.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.419 -179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -59.58 -43.5 93.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.128 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.405 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 64.9 m-70 -69.86 -45.48 67.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.441 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.404 HD23 ' CE1' ' B' ' 34' ' ' TYR . 51.2 tp -51.57 -28.68 14.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.543 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -55.03 -29.37 57.26 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.394 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.02 -35.5 73.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.61 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.04 -49.39 37.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.773 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.452 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -55.48 -42.06 73.84 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.524 HD21 ' NH2' ' B' ' 68' ' ' ARG . 48.3 t30 -68.56 -36.84 79.32 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.281 0.562 . . . . 0.0 110.854 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -60.33 -41.37 93.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.431 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 90.7 t -67.46 -47.85 79.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 121.67 0.748 . . . . 0.0 110.608 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -44.61 94.89 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.926 0.87 . . . . 0.0 111.381 -179.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.524 ' NH2' HD21 ' B' ' 64' ' ' ASN . 42.6 ttm180 -63.74 -21.14 66.26 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.964 -179.044 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.48 -20.21 14.0 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 70.2 mm-40 -100.79 -5.7 25.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.666 0.269 . . . . 0.0 110.613 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 92.9 p -43.16 158.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.441 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -58.62 -53.79 54.33 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.371 -0.531 . . . . 0.0 110.451 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 11.3 mt -76.82 134.15 39.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.653 0.74 . . . . 0.0 110.43 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 94.2 mt-10 -143.74 153.79 42.79 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-O 122.508 1.147 . . . . 0.0 109.701 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 -146.49 127.66 14.73 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 114.468 -1.242 . . . . 0.0 110.745 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.576 ' CD2' ' H ' ' B' ' 77' ' ' HIS . 84.6 t60 -169.76 -116.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.645 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.576 ' H ' ' CD2' ' B' ' 76' ' ' HIS . 78.3 t60 -159.86 5.93 0.09 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.343 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 99.6 m-70 51.56 -172.91 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.617 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 83.7 t60 -158.07 139.26 13.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.574 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 11.5 p80 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.48 -179.893 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.4 m -61.52 -40.23 93.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.46 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 tp10 56.75 71.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.395 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.656 HD12 ' N ' ' A' ' 4' ' ' LEU . 6.3 mp 50.38 -125.79 2.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.155 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.8 t80 59.25 -69.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.026 0.441 . . . . 0.0 110.59 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.587 ' N ' ' O ' ' A' ' 4' ' ' LEU . 0.3 OUTLIER -63.18 130.92 46.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.042 -179.897 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.602 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.6 t -67.31 -39.3 19.77 Favored Pre-proline 0 CA--C 1.538 0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.051 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 60.7 Cg_exo -53.08 -25.97 30.88 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 121.834 1.689 . . . . 0.0 111.951 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -60.18 -43.19 96.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.818 0.342 . . . . 0.0 110.422 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.455 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.3 m-85 -57.08 -40.46 76.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.293 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 60.5 mt -68.08 -44.2 84.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.09 0.472 . . . . 0.0 110.352 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -51.13 -30.75 17.41 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.614 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -69.08 -32.07 71.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.14 0.495 . . . . 0.0 110.501 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 22.4 mt -73.21 -38.63 66.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.4 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -56.09 -34.01 65.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.105 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.2 tt0 -67.77 -33.42 74.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.402 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.4 m170 -65.35 -51.42 60.63 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.785 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.9 pt -72.16 -40.07 65.8 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.321 0.581 . . . . 0.0 110.782 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -67.83 -53.78 24.23 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.136 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.419 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 44.7 mtt -98.74 -65.0 0.99 Allowed 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.091 0.472 . . . . 0.0 110.086 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 21.0 t30 80.99 47.91 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.878 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -53.27 -40.76 64.93 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.299 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 86.2 p -158.87 64.91 0.41 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.713 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -161.89 -132.09 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.334 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.489 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 64.5 m-20 -158.66 -172.03 3.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.36 0.6 . . . . 0.0 110.062 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.5 ttpm? -77.73 -104.62 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.593 179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.555 ' C ' ' H ' ' A' ' 29' ' ' ALA . 16.2 tt -63.97 -36.02 75.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.046 0.451 . . . . 0.0 110.768 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -68.05 16.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.92 -44.99 21.46 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.246 0.546 . . . . 0.0 110.263 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.647 ' O ' ' N ' ' A' ' 34' ' ' TYR . 26.3 tpp -61.9 -48.59 79.77 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.957 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.495 ' OD1' ' ND2' ' B' ' 31' ' ' ASN . 62.6 t-20 -47.28 -53.23 14.0 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.038 -0.665 . . . . 0.0 110.724 -177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.1 m -62.1 -50.31 72.43 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.959 178.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 40.8 t80 -67.2 -21.97 65.75 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.812 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.647 ' N ' ' O ' ' A' ' 30' ' ' MET . 45.2 t80 -73.91 -60.33 2.31 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.342 -179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 16.7 ptm180 -61.16 -26.33 67.62 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.922 179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -66.23 -47.89 72.33 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.708 0.289 . . . . 0.0 110.491 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.8 t -70.6 -48.06 60.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.681 -0.407 . . . . 0.0 110.422 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.455 HG21 ' CE1' ' A' ' 34' ' ' TYR . 99.2 t -62.46 -53.96 40.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.716 -179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 13.6 m -59.7 -18.39 42.02 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.36 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 23.0 m -87.51 -49.32 7.27 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.102 0.477 . . . . 0.0 111.078 179.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' CD1' ' HE ' ' A' ' 55' ' ' ARG . 96.6 mt -70.81 -42.85 69.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.66 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 42' ' ' VAL . 43.4 t -78.3 27.31 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.401 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 41' ' ' LEU . 74.6 mt-30 -147.61 2.92 0.73 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.6 -0.273 . . . . 0.0 110.729 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 46' ' ' LEU . 38.5 t70 -150.37 168.09 25.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.133 0.492 . . . . 0.0 110.278 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.409 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.9 tt0 67.31 -64.86 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.504 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.441 ' N ' ' O ' ' A' ' 44' ' ' ASP . 19.1 mt 36.96 43.34 0.29 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.332 0.587 . . . . 0.0 111.183 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.3 t -76.53 -31.85 57.87 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.425 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -170.82 131.32 0.84 Allowed 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.645 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 67.7 m-20 -50.07 -37.69 34.78 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.626 179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.87 -48.46 71.47 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-O 121.315 0.578 . . . . 0.0 110.555 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 17.9 t -53.39 -44.02 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.628 -179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -78.12 -36.63 21.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 CA-C-O 121.012 0.434 . . . . 0.0 111.09 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 61.2 tp -62.22 -47.66 83.45 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.71 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 15.5 pttp -50.2 -38.44 40.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.206 0.527 . . . . 0.0 110.21 -178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.428 ' HE ' ' CD1' ' A' ' 41' ' ' LEU . 15.2 mmm180 -64.55 -38.4 90.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.173 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 49.0 mm -64.01 -51.12 73.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.575 -0.284 . . . . 0.0 110.302 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.426 HE22 HG11 ' B' ' 42' ' ' VAL . 97.1 mm-40 -53.58 -45.29 69.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.367 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.404 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 2.2 m80 -65.08 -38.28 90.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.545 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -54.54 -30.43 53.93 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.172 -178.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -61.41 -32.1 72.04 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.036 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -59.31 -40.46 86.32 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.199 0.524 . . . . 0.0 110.844 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.63 -49.27 33.04 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.237 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -49.75 -43.1 47.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.246 -0.434 . . . . 0.0 109.944 -179.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.572 ' ND2' ' NE ' ' A' ' 68' ' ' ARG . 1.7 t-20 -66.95 -35.84 80.87 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.333 0.587 . . . . 0.0 110.372 -179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.492 ' O ' ' N ' ' A' ' 69' ' ' GLY . 30.7 tptt -69.61 -41.43 75.72 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.507 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.4 t -62.63 -46.19 96.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 122.12 0.962 . . . . 0.0 110.664 -178.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.461 ' HD3' HD11 ' A' ' 27' ' ' ILE . 26.7 mmtm -66.84 -43.11 84.58 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.449 -179.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.572 ' NE ' ' ND2' ' A' ' 64' ' ' ASN . 78.0 mtm180 -81.51 -15.14 55.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.454 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -92.88 -37.76 5.66 Favored Glycine 0 N--CA 1.471 1.012 0 N-CA-C 110.994 -0.843 . . . . 0.0 110.994 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.447 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.7 pp20? -73.5 -35.27 65.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.055 0.455 . . . . 0.0 110.378 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.4 m -126.79 114.64 18.22 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-O 121.58 0.705 . . . . 0.0 110.472 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -81.0 -13.36 58.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.504 179.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.7 mt -72.41 -75.48 0.14 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.256 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 46.91 38.59 6.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.015 0.436 . . . . 0.0 110.498 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 66.5 t60 -163.87 133.17 3.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.201 0.524 . . . . 0.0 110.524 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -82.47 67.93 8.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.273 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 58.8 t-80 -65.81 -45.97 80.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.623 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -79.8 158.53 26.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.364 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.437 ' O ' ' CG ' ' A' ' 80' ' ' HIS . 98.1 m-70 52.58 -165.59 0.07 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.675 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.437 ' CG ' ' O ' ' A' ' 79' ' ' HIS . 71.3 m80 . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 118.092 -0.956 . . . . 0.0 110.484 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.7 ptt? . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 91.0 p -58.68 120.06 8.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.059 0.457 . . . . 0.0 110.505 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -84.75 167.4 16.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.314 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 60.5 mt 55.47 22.21 4.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.293 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -60.86 -47.61 85.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.282 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 3.4 m -79.42 119.31 22.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.295 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.503 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -56.44 -45.49 99.92 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.197 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.503 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 88.5 Cg_exo -45.78 -23.52 1.64 Allowed 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 121.533 1.489 . . . . 0.0 112.615 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -60.91 -39.96 91.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.354 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -60.36 -42.35 95.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.347 -179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.33 -45.3 98.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.056 0.455 . . . . 0.0 110.437 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -48.61 -28.38 3.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.577 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -74.37 -39.76 62.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.039 0.447 . . . . 0.0 110.538 178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.6 mt -69.49 -46.22 67.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.329 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -62.79 -26.06 68.54 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.459 0.647 . . . . 0.0 110.519 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -63.45 -29.63 70.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.569 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.573 ' NE2' ' O ' ' B' ' 25' ' ' ASP . 82.8 t60 -81.84 -61.56 1.88 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.258 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.418 ' H ' HG23 ' B' ' 18' ' ' ILE . 2.7 pt -50.5 -37.25 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 CA-C-O 121.385 0.612 . . . . 0.0 110.359 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.0 tt0 -74.14 -55.5 6.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.662 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.4 mpt? -101.52 -119.76 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.055 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.448 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 21.2 p-10 -176.42 74.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.258 -179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -79.89 -72.34 0.41 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.221 0.534 . . . . 0.0 110.245 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 28.5 p -172.99 85.19 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.359 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . 0.441 ' N ' ' CE1' ' B' ' 17' ' ' HIS . 9.4 tp10 -169.73 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.562 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.573 ' O ' ' NE2' ' B' ' 17' ' ' HIS . 91.7 m-20 -135.36 -95.9 0.25 Allowed 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.741 0.305 . . . . 0.0 110.339 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -163.13 -99.51 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.178 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.0 mm -64.93 -40.59 89.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.131 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 83.6 m-70 -71.18 -14.53 62.3 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.462 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.21 -40.4 5.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.76 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.558 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -66.17 -48.36 70.98 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 178.744 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.495 ' ND2' ' OD1' ' A' ' 31' ' ' ASN . 39.8 t-20 -57.1 -48.53 78.39 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.694 -178.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 41.1 t -62.51 -44.72 95.67 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.347 0.594 . . . . 0.0 111.014 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -73.96 -46.75 42.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.869 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.809 ' O ' HG23 ' B' ' 38' ' ' VAL . 50.5 t80 -49.15 -40.46 32.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.891 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.521 ' NH2' ' CG ' ' A' ' 34' ' ' TYR . 42.7 ttm180 -72.57 -30.22 64.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.088 179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 12.5 t -61.56 -43.19 99.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.318 -0.253 . . . . 0.0 110.318 -179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.537 HG12 HD23 ' B' ' 41' ' ' LEU . 87.3 t -73.19 -43.73 56.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.023 0.439 . . . . 0.0 110.577 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.809 HG23 ' O ' ' B' ' 34' ' ' TYR . 88.6 t -54.71 -45.99 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.585 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 42.2 t -58.83 -41.62 87.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.901 0.381 . . . . 0.0 110.402 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 31.5 m -72.32 -46.03 57.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.207 0.527 . . . . 0.0 110.775 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.537 HD23 HG12 ' B' ' 37' ' ' VAL . 0.6 OUTLIER -53.33 -30.5 39.51 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.534 -179.451 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.426 HG11 HE22 ' A' ' 57' ' ' GLN . 87.9 t -90.71 -28.4 4.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.306 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 43.1 tp60 -73.86 -22.4 59.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.48 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' B' ' 41' ' ' LEU . 44.9 p30 -79.99 -176.06 5.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.047 0.451 . . . . 0.0 110.302 -179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -43.26 141.58 1.24 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.688 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.1 mt -122.9 61.63 1.01 Allowed 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.24 -179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.441 HG22 ' H ' ' B' ' 47' ' ' THR . 0.9 OUTLIER -63.45 -31.54 72.73 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.141 -0.482 . . . . 0.0 109.936 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -168.08 126.84 1.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.848 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.491 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 23.4 p30 -46.87 -28.46 1.59 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.472 179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.491 ' N ' ' OD1' ' B' ' 49' ' ' ASN . . . -73.59 -51.25 17.52 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 121.289 0.566 . . . . 0.0 110.555 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 22.9 t -49.22 -44.94 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.657 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.0 m -73.4 -35.71 46.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.356 0 CA-C-O 121.193 0.521 . . . . 0.0 110.742 179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 14.0 mt -66.53 -27.97 68.18 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.537 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.485 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 55.8 mttp -53.84 -44.44 70.32 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.387 -0.525 . . . . 0.0 109.987 -179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.48 ' HD2' HD11 ' B' ' 41' ' ' LEU . 44.2 mtt180 -68.65 -38.89 80.81 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.483 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.426 HD12 HG22 ' B' ' 38' ' ' VAL . 32.0 mm -63.33 -52.61 56.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.298 -179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -57.35 -37.69 72.98 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.485 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 27.6 m-70 -74.82 -44.29 50.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.514 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 31.9 tp -55.35 -29.67 58.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.239 -179.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.406 ' OD1' ' OH ' ' B' ' 34' ' ' TYR . 87.9 m-20 -51.58 -38.76 55.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.333 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.75 -30.34 32.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.463 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.44 -54.02 14.05 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.487 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.483 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -50.05 -39.07 40.81 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.268 0.556 . . . . 0.0 110.074 -179.774 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.483 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 50.2 t30 -72.66 -38.83 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.418 ' CE ' HH21 ' B' ' 68' ' ' ARG . 46.5 mmtt -61.66 -39.57 91.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.343 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.1 t -60.3 -50.16 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.15 -179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 17.8 mtmt -72.72 -49.88 28.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.54 0.686 . . . . 0.0 111.661 179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.418 HH21 ' CE ' ' B' ' 65' ' ' LYS . 68.8 ttp85 -57.14 -32.22 66.15 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.86 -179.003 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.65 -12.72 84.21 Favored Glycine 0 CA--C 1.524 0.625 0 N-CA-C 110.75 -0.94 . . . . 0.0 110.75 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -103.88 -176.9 3.21 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.91 0.386 . . . . 0.0 110.559 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.494 ' O ' ' N ' ' B' ' 73' ' ' LEU . 76.7 p 48.77 -153.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.699 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 68.6 mttm 51.14 -87.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.763 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' B' ' 71' ' ' SER . 26.2 mt -79.71 -0.37 33.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.225 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.456 ' O ' ' O ' ' B' ' 75' ' ' HIS . 95.3 mt-10 55.18 9.69 0.36 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.046 0.451 . . . . 0.0 110.414 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.456 ' O ' ' O ' ' B' ' 74' ' ' GLU . 83.8 t60 58.12 145.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.643 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -91.28 140.28 29.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.951 0.405 . . . . 0.0 110.429 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 48.3 p-80 -147.59 2.8 0.73 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.64 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 86.6 t60 -65.43 -43.44 90.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.357 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -61.19 -41.5 96.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.442 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.6 p-80 . . . . . 0 C--O 1.221 -0.444 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.576 -179.949 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 p 53.29 99.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.51 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.3 tm-20 -97.09 117.24 30.83 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 121.408 0.623 . . . . 0.0 110.158 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.09 3.7 1.06 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.507 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -62.29 -43.27 99.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.062 0.458 . . . . 0.0 110.384 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -71.2 132.12 44.52 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.23 -179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.51 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -61.24 -43.75 91.09 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.51 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.6 Cg_exo -49.59 -27.46 14.68 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 C-N-CA 121.104 1.203 . . . . 0.0 112.267 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.26 -42.45 99.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.739 0.304 . . . . 0.0 110.527 -179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -58.61 -44.1 89.81 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.048 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 48.3 mt -67.44 -43.71 87.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.243 0.544 . . . . 0.0 110.595 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -51.94 -33.38 37.15 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.499 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.9 m-20 -67.37 -32.06 72.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.077 0.465 . . . . 0.0 110.4 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 26.8 mt -71.41 -38.72 71.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.626 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -53.77 -34.37 58.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.046 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -66.8 -36.65 82.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.491 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -61.6 -51.91 66.57 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.652 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 pt -73.42 -43.57 55.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.866 179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -65.79 -51.87 55.43 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.472 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 34.9 mtt -104.5 -160.68 0.78 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.151 0.501 . . . . 0.0 110.096 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -154.54 51.87 0.64 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.276 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -59.3 -50.56 73.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.962 0.41 . . . . 0.0 110.38 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 p -177.15 71.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.45 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -167.87 -132.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.307 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -155.44 -166.42 2.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.038 0.447 . . . . 0.0 110.406 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -83.92 -104.27 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.129 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.609 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.8 tt -63.41 -39.28 84.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 52.0 t-80 -63.39 10.08 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.159 179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.542 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -76.93 -44.43 31.58 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.003 0.43 . . . . 0.0 110.638 178.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.416 ' O ' ' CB ' ' A' ' 34' ' ' TYR . 0.2 OUTLIER -62.86 -46.64 86.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.012 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' OD1' ' NH2' ' B' ' 35' ' ' ARG . 44.5 t30 -53.58 -48.97 68.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.641 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 62.4 p -64.77 -54.06 37.24 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.906 179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.9 t80 -61.03 -42.72 99.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.316 0.579 . . . . 0.0 110.384 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.416 ' CB ' ' O ' ' A' ' 30' ' ' MET . 44.3 t80 -55.45 -48.06 75.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.909 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -75.56 -20.43 58.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.731 0.3 . . . . 0.0 110.471 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 10.9 t -68.22 -50.8 51.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.502 -179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.489 HG23 ' N ' ' A' ' 38' ' ' VAL . 4.7 m -74.82 -45.94 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.804 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.489 ' N ' HG23 ' A' ' 37' ' ' VAL . 55.2 t -56.45 -48.27 80.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 C-N-CA 120.55 -0.46 . . . . 0.0 109.824 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -61.23 -42.26 98.29 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 85.4 m -69.31 -46.81 66.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.801 0.334 . . . . 0.0 110.743 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.627 HD22 HH11 ' A' ' 55' ' ' ARG . 82.5 mt -62.66 -30.37 71.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.37 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 38' ' ' VAL . 74.7 t -85.32 -38.01 12.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.599 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -67.49 -6.44 19.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.252 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.473 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 54.5 p30 -149.05 165.86 30.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.901 0.381 . . . . 0.0 110.506 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.484 HE22 ' NH2' ' A' ' 55' ' ' ARG . 51.0 tt0 82.78 -73.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.499 179.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.2 mt 43.52 42.28 3.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.119 0.485 . . . . 0.0 110.975 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.8 m -62.27 -37.8 86.85 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.433 0.635 . . . . 0.0 110.227 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.52 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 57.9 tttp -178.6 145.03 0.3 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.516 -178.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -57.43 -40.65 78.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.662 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.52 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -66.36 -47.74 72.43 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.511 -0.475 . . . . 0.0 111.021 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.0 t -53.58 -65.21 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 120.021 -0.672 . . . . 0.0 111.229 -178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.6 m -48.7 -32.14 4.15 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.955 -179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.21 -41.15 96.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.883 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 25.1 mtpp -59.67 -41.98 91.85 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.098 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.627 HH11 HD22 ' A' ' 41' ' ' LEU . 94.0 mtt180 -65.18 -41.83 94.22 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.056 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.0 mt -67.7 -51.55 49.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.429 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.438 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 15.4 mm100 -56.95 -41.19 77.85 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.402 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 19.2 m-70 -71.06 -41.88 70.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.689 0.28 . . . . 0.0 110.364 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.2 tp -53.47 -22.56 8.2 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.598 -179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 4.3 p-10 -57.41 -30.49 64.98 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.486 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.5 pt-20 -60.7 -33.64 73.17 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.793 0.33 . . . . 0.0 110.257 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.11 -57.46 4.01 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.883 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.45 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.98 -39.21 25.71 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.928 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.45 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 52.4 t30 -70.87 -39.95 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.931 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -60.66 -46.82 88.86 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.264 -178.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 84.3 t -54.83 -55.07 17.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.163 -0.615 . . . . 0.0 110.326 -179.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.609 ' HD2' HD11 ' A' ' 27' ' ' ILE . 16.1 mtmt -60.35 -46.22 90.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.177 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.0 tpt85 -58.25 -14.06 6.41 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.719 179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -100.45 -24.88 9.1 Favored Glycine 0 CA--C 1.525 0.659 0 N-CA-C 110.819 -0.912 . . . . 0.0 110.819 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 51.3 mm-40 -54.41 -104.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 86.2 p -166.8 -128.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.025 0.441 . . . . 0.0 110.678 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 pttm -160.04 83.65 0.72 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.34 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.2 tp -172.64 51.33 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.244 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -89.86 63.95 6.22 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.945 0.402 . . . . 0.0 110.208 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 58.85 77.78 0.29 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.446 -179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.5 m80 54.36 87.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.322 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' A' ' 79' ' ' HIS . 10.1 t-80 -75.55 107.53 7.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.964 0.412 . . . . 0.0 110.339 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -54.29 -76.82 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.569 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.476 ' O ' ' ND1' ' A' ' 77' ' ' HIS . 72.1 m80 -61.15 159.96 11.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.442 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 74.1 m80 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.464 -179.886 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mmt . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 15.3 m -157.05 -6.27 0.1 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.562 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.562 ' C ' ' H ' ' B' ' 5' ' ' PHE . 94.7 mt-10 -71.46 -120.88 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.121 0.486 . . . . 0.0 110.382 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 40.3 mt 61.79 -6.27 0.13 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.767 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.562 ' H ' ' C ' ' B' ' 3' ' ' GLU . 43.1 m-85 -71.15 -33.9 70.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.257 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -74.12 133.11 42.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.1 t -72.43 -38.48 5.34 Favored Pre-proline 0 CA--C 1.537 0.457 0 CA-C-O 119.306 -0.378 . . . . 0.0 109.992 179.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 59.6 Cg_exo -53.48 -28.61 45.5 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.379 1.386 . . . . 0.0 111.806 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -60.64 -44.46 96.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.68 0.276 . . . . 0.0 110.352 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.46 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.1 m-85 -58.18 -37.53 74.93 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.147 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.68 -47.1 72.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.396 0.617 . . . . 0.0 110.683 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -51.37 -25.91 6.87 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.525 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -70.31 -31.42 68.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.139 0.495 . . . . 0.0 110.373 179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 24.8 mt -72.69 -39.74 66.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.685 -179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -32.83 68.09 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.041 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.426 ' CD ' ' NE2' ' B' ' 22' ' ' GLN . 48.3 tt0 -66.37 -30.65 71.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.573 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -69.16 -51.98 32.74 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.712 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 7.4 pt -72.81 -44.44 58.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-O 121.044 0.45 . . . . 0.0 110.709 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.6 tt0 -63.71 -53.02 57.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.693 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.9 mmt -96.29 -147.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 109.874 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -171.21 45.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.013 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.426 ' NE2' ' CD ' ' B' ' 16' ' ' GLN . 50.2 mt-30 -54.85 -46.12 74.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.889 0.376 . . . . 0.0 110.659 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 5.3 t 178.52 68.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.445 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . 0.415 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 16.9 tp10 -160.9 -130.99 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.399 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -160.37 -171.81 3.32 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.362 0.601 . . . . 0.0 110.369 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -78.44 -106.45 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.442 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.132 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.488 ' C ' ' H ' ' B' ' 29' ' ' ALA . 20.0 tt -64.83 -32.79 59.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.615 0.245 . . . . 0.0 110.691 -179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -66.09 7.78 0.26 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.608 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.07 -43.0 36.01 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.267 0.556 . . . . 0.0 110.575 179.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.476 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 16.2 ptt? -59.45 -47.1 86.78 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.355 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.476 ' N ' ' CG ' ' B' ' 30' ' ' MET . 33.6 m120 -54.14 -43.41 70.51 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.501 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.415 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 78.3 p -70.65 -55.43 8.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.727 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.46 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 42.2 t80 -59.59 -46.15 89.79 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.216 0.531 . . . . 0.0 110.598 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.418 ' CB ' ' O ' ' B' ' 30' ' ' MET . 59.4 t80 -55.77 -48.55 75.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.004 -179.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.476 ' NH2' ' OD1' ' A' ' 31' ' ' ASN . 44.5 ttm180 -71.51 -24.06 61.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.393 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 21.5 t -70.04 -50.99 35.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.896 0.379 . . . . 0.0 110.488 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.0 t -68.18 -56.73 11.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.5 -179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 69.1 t -48.44 -49.73 13.0 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.328 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 71.3 m -57.81 -36.41 72.19 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.3 m -71.21 -49.99 37.73 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.949 0.404 . . . . 0.0 111.309 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.3 mt -53.23 -36.62 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.294 -179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 71.0 t -80.1 -38.63 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.411 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -115.93 78.16 1.16 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.407 0.622 . . . . 0.0 110.237 -179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -178.38 -69.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 121.765 0.793 . . . . 0.0 110.716 179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 67.8 tp60 -86.34 -74.89 0.4 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.201 -0.908 . . . . 0.0 110.54 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tt 69.28 43.67 1.04 Allowed 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.165 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.4 t -80.75 -27.69 36.73 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.334 0.587 . . . . 0.0 110.524 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -178.7 145.81 0.32 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.8 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.455 HD22 ' N ' ' A' ' 50' ' ' ALA . 18.3 p-10 -64.26 -45.03 89.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.073 0.463 . . . . 0.0 110.609 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.56 -39.93 85.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.832 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 12.6 t -57.93 -62.11 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.845 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 28.5 m -54.19 -33.81 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 120.247 -0.581 . . . . 0.0 110.574 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.72 -60.63 3.28 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.689 -178.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.456 ' O ' ' CD2' ' B' ' 58' ' ' HIS . 16.8 ptpt -58.23 -35.59 71.92 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.674 -0.41 . . . . 0.0 109.929 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -62.91 -35.72 81.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.078 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 88.4 mt -71.23 -46.2 66.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.492 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -54.75 -25.37 27.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.14 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.456 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 50.8 m170 -70.2 -44.97 67.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.211 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.408 HD13 ' HB3' ' B' ' 62' ' ' ALA . 0.5 OUTLIER -51.61 -20.98 2.25 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 120.472 -0.491 . . . . 0.0 110.591 -179.383 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -59.46 -45.31 91.99 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.008 -0.677 . . . . 0.0 110.178 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -63.14 -37.68 88.17 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.065 0.46 . . . . 0.0 110.654 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . 0.408 ' HB3' HD13 ' B' ' 59' ' ' LEU . . . -72.36 -53.89 11.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.913 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.03 -37.71 21.57 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-O 121.101 0.476 . . . . 0.0 109.773 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -65.6 -37.21 85.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.652 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 15.5 tptp -55.34 -39.57 70.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.717 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 85.1 t -66.24 -39.27 83.84 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.368 0 CA-C-O 121.836 0.827 . . . . 0.0 110.515 -179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -64.91 -46.85 79.95 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.803 -178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.5 mmm180 -86.05 -12.24 50.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.336 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -92.57 -37.15 5.91 Favored Glycine 0 N--CA 1.476 1.364 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' B' ' 71' ' ' SER . 1.1 pp20? -67.34 -165.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.012 0.434 . . . . 0.0 110.207 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.408 ' O ' ' OE2' ' B' ' 70' ' ' GLU . 31.3 t -44.5 109.21 0.14 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.194 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.8 tttt 179.61 12.08 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.38 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.574 ' O ' ' N ' ' B' ' 75' ' ' HIS . 41.0 tp -173.82 -99.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 37.34 22.83 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.325 0.583 . . . . 0.0 111.182 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.612 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 0.0 OUTLIER -46.07 -87.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.429 -178.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.612 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 79.4 m80 -97.83 159.2 15.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.194 0.521 . . . . 0.0 110.294 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -163.37 137.33 5.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.296 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -71.5 149.0 46.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.286 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 77.8 m80 -58.99 -42.57 90.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.454 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 30.1 p80 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.607 179.915 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.4 mtp . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.8 p -77.47 178.96 6.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.41 ' C ' ' N ' ' A' ' 5' ' ' PHE . 96.2 mt-10 -70.41 147.4 49.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.386 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 60.3 mt 53.65 11.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.58 179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.41 ' N ' ' C ' ' A' ' 3' ' ' GLU . 73.1 t80 -61.24 -47.39 86.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.384 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 2.3 m -91.56 127.48 37.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.407 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.464 ' CG1' ' NE2' ' A' ' 58' ' ' HIS . 1.0 OUTLIER -58.52 -46.52 99.6 Favored Pre-proline 0 CA--C 1.539 0.552 0 CA-C-O 118.751 -0.642 . . . . 0.0 109.748 179.001 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 99.1 Cg_exo -40.66 -29.78 0.46 Allowed 'Trans proline' 0 N--CA 1.497 1.724 0 C-N-CA 121.248 1.299 . . . . 0.0 112.764 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -59.15 -48.36 81.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.183 -179.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.56 -47.15 85.14 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.763 0.316 . . . . 0.0 110.26 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 51.9 mt -61.14 -47.44 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 CA-C-O 121.324 0.583 . . . . 0.0 110.41 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 -46.27 -32.55 3.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.745 -178.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 43.5 m-20 -60.85 -35.75 77.36 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.2 mp -76.52 -40.06 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.782 179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -62.59 -35.43 79.5 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 120.867 0.365 . . . . 0.0 110.256 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -59.48 -29.94 68.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.584 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -72.68 -56.04 5.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.172 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.462 HG22 ' HA ' ' A' ' 26' ' ' LYS . 2.1 pt -67.38 -42.33 87.28 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.335 0.588 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.422 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.8 tt0 -62.24 -53.42 55.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.639 -178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 51.3 mtt -98.58 -132.4 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -170.35 50.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.449 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.6 tp60 -58.1 -50.58 72.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.596 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.0 p -174.19 21.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.63 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -134.9 175.04 9.93 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.368 1.08 . . . . 0.0 109.806 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -112.23 -126.5 0.28 Allowed 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.364 -179.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.462 ' HA ' HG22 ' A' ' 18' ' ' ILE . 99.4 mttt -113.42 -87.93 0.56 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.663 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.4 mm -68.12 -24.17 29.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.683 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 27.1 m80 -84.67 -9.7 58.0 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.376 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.36 -51.23 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.828 0.347 . . . . 0.0 110.496 179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.556 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -64.14 -41.06 97.35 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.364 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.556 ' N ' ' SD ' ' A' ' 30' ' ' MET . 50.3 t30 -56.62 -51.78 67.38 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.354 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 40.9 t -65.27 -51.36 61.3 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.773 179.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -60.71 -53.55 56.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.46 -179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.428 ' N ' ' O ' ' A' ' 30' ' ' MET . 38.3 t80 -54.84 -48.75 72.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.903 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.457 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.3 tpt180 -60.28 -40.03 88.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.918 0.389 . . . . 0.0 110.183 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.1 m -64.8 -41.14 96.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.0 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 61.9 t -71.23 -60.44 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 C-N-CA 119.711 -0.795 . . . . 0.0 110.63 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.502 HG13 ' N ' ' A' ' 39' ' ' SER . 8.3 p -52.15 -43.42 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.252 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.502 ' N ' HG13 ' A' ' 38' ' ' VAL . 69.6 m -62.53 -50.25 72.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.355 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -57.94 -43.99 86.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.375 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -71.21 -45.63 62.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.259 0.552 . . . . 0.0 110.631 -179.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.691 HG12 ' O ' ' A' ' 42' ' ' VAL . 61.0 t -82.33 26.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.29 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -159.98 19.23 0.16 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.319 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.6 t0 -168.77 21.49 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.584 0.231 . . . . 0.0 110.467 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -172.3 62.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.488 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 30.8 mt -100.66 50.52 0.88 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.369 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.2 t -72.31 -34.68 68.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.385 0.612 . . . . 0.0 110.436 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -163.92 132.07 3.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.9 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.439 ' OD1' ' N ' ' A' ' 50' ' ' ALA . 19.4 p30 -48.59 -36.63 16.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.605 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.439 ' N ' ' OD1' ' A' ' 49' ' ' ASN . . . -69.18 -53.24 21.05 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.405 0.621 . . . . 0.0 111.03 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.6 t -48.24 -44.31 12.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.564 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -75.8 -40.16 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.985 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 14.2 mt -59.34 -40.5 86.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.548 -179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -52.82 -50.2 64.14 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.531 -0.467 . . . . 0.0 109.921 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -62.38 -43.16 99.49 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.259 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.5 mt -64.01 -55.64 20.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.136 -0.626 . . . . 0.0 110.638 -179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.8 mt-30 -50.92 -41.26 58.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.167 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.464 ' NE2' ' CG1' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -73.05 -43.45 61.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.261 -0.427 . . . . 0.0 109.902 179.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.492 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 41.3 tp -56.89 -29.63 63.17 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.347 -0.541 . . . . 0.0 110.782 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.0 t0 -52.79 -52.56 56.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.246 -0.582 . . . . 0.0 110.377 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -51.39 -29.49 15.81 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.83 0.348 . . . . 0.0 110.758 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -66.34 -62.26 1.57 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.764 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.38 -43.36 64.69 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -61.61 -25.77 67.56 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.25 -179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.559 ' NZ ' ' NH2' ' A' ' 68' ' ' ARG . 31.2 tptt -75.1 -32.74 61.5 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.622 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.5 t -67.21 -52.4 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.374 0 CA-C-O 121.367 0.604 . . . . 0.0 110.465 -179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -47.17 79.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.84 0.828 . . . . 0.0 111.6 -179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.559 ' NH2' ' NZ ' ' A' ' 65' ' ' LYS . 70.7 ttp85 -57.17 -24.74 56.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.981 -179.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -84.22 -16.21 67.5 Favored Glycine 0 CA--C 1.522 0.48 0 N-CA-C 110.578 -1.009 . . . . 0.0 110.578 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -92.66 175.82 6.67 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.167 0.508 . . . . 0.0 110.492 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 63.5 m 46.53 -172.26 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.398 -179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.0 mtpp -141.86 -65.95 0.41 Allowed 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.534 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' O ' ' CD2' ' A' ' 75' ' ' HIS . 4.3 mm? -53.3 -57.68 9.71 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 -179.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 58.55 48.5 11.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.315 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.494 ' CD2' ' O ' ' A' ' 73' ' ' LEU . 89.6 m-70 -148.3 163.12 38.03 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.488 0.661 . . . . 0.0 110.599 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.401 ' O ' ' CG ' ' A' ' 76' ' ' HIS . 18.8 t-80 -132.59 45.86 2.7 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.699 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 73.0 m-70 -79.18 54.57 1.67 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.385 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -61.35 -45.9 92.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.446 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -134.77 -47.23 0.74 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.728 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.9 t60 . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.508 -179.82 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 79.2 p -156.42 129.0 7.68 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.589 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.4 tp10 -93.98 78.58 4.11 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.373 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 54.4 mt -69.91 -21.79 63.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.321 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 99.3 m-85 -59.48 -42.46 92.13 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.271 -179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -86.15 126.71 34.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.321 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.507 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.4 t -60.58 -41.98 85.86 Favored Pre-proline 0 CA--C 1.536 0.431 0 CA-C-O 118.662 -0.685 . . . . 0.0 109.837 178.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.507 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 79.9 Cg_exo -47.21 -34.27 17.61 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 C-N-CA 121.123 1.215 . . . . 0.0 112.223 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 88.2 t80 -55.45 -41.95 73.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.183 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -44.83 95.39 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.383 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.414 ' O ' ' N ' ' B' ' 14' ' ' LEU . 30.5 mt -60.61 -48.29 89.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.456 -179.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -45.31 -32.4 1.99 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.66 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -59.14 -35.31 73.26 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.639 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.0 mp -73.19 -38.22 66.22 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.775 0.321 . . . . 0.0 110.307 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.95 -34.41 77.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.043 0.449 . . . . 0.0 110.315 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -64.51 -28.85 69.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.626 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 10.7 m-70 -72.18 -53.63 12.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.858 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.447 HD12 ' OE1' ' B' ' 70' ' ' GLU . 6.2 pt -70.63 -43.04 77.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.313 0.577 . . . . 0.0 110.729 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -59.09 -39.55 82.53 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.204 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -126.0 -135.26 0.26 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 120.907 0.385 . . . . 0.0 110.552 179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 43.7 p30 -173.3 55.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.268 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -60.07 -44.82 94.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 0.0 110.285 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.0 t 175.33 71.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.295 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 27.1 tp10 -166.25 -124.76 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 120.798 0.332 . . . . 0.0 110.393 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -156.94 -168.71 2.73 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.312 0.577 . . . . 0.0 110.006 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -89.8 -98.63 0.1 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.37 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 3.1 mm -61.5 -44.42 98.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 C-N-CA 120.191 -0.604 . . . . 0.0 109.811 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -57.58 -8.35 0.84 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 120.497 -0.481 . . . . 0.0 110.582 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.66 -48.34 75.17 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.532 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.427 ' O ' ' N ' ' B' ' 34' ' ' TYR . 2.3 ptm -67.15 -50.31 61.71 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.457 ' OD1' ' NH1' ' A' ' 35' ' ' ARG . 91.5 m-20 -56.89 -44.76 82.62 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.508 -179.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -69.96 -51.23 34.34 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.805 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.523 ' CE1' HD11 ' B' ' 14' ' ' LEU . 44.5 t80 -63.63 -51.65 64.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.827 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.769 ' O ' HG23 ' B' ' 38' ' ' VAL . 57.0 t80 -52.66 -44.44 66.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.022 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 5.5 tmm_? -69.33 -36.7 77.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.573 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 45.1 m -60.55 -39.12 86.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.407 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 83.9 t -73.74 -54.97 13.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.32 179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.769 HG23 ' O ' ' B' ' 34' ' ' TYR . 49.1 t -48.49 -38.21 8.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.501 -179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.403 ' O ' ' CB ' ' B' ' 43' ' ' GLN . 77.6 p -64.95 -47.11 78.83 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.802 -0.359 . . . . 0.0 110.087 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.6 m -65.57 -46.12 80.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.445 0.641 . . . . 0.0 111.234 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.455 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -62.9 -34.99 78.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.651 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 79.2 t -85.59 -37.99 12.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.016 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.403 ' CB ' ' O ' ' B' ' 39' ' ' SER . 47.8 tt0 -75.93 -0.5 21.66 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.661 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.455 ' O ' ' O ' ' B' ' 41' ' ' LEU . 46.6 m-20 -157.13 171.54 20.25 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.291 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 52.24 42.36 30.77 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.578 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 mp -82.98 43.63 0.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.422 HG23 ' N ' ' B' ' 48' ' ' LYS . 4.6 t -65.4 -43.21 91.32 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 121.446 0.641 . . . . 0.0 110.557 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' B' ' 50' ' ' ALA . 28.7 tptp -158.22 131.47 7.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.643 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -46.54 -42.78 16.31 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.267 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.437 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -62.28 -50.84 70.09 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 120.491 -0.484 . . . . 0.0 110.934 179.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 28.5 t -51.0 -46.85 30.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.451 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.424 ' O ' HG12 ' B' ' 56' ' ' ILE . 29.3 m -76.3 -45.09 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 CA-C-O 121.594 0.711 . . . . 0.0 111.146 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.417 ' N ' HG23 ' B' ' 52' ' ' VAL . 60.9 tp -56.84 -42.69 80.11 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.606 -178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -53.48 -45.33 69.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.184 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.45 -40.13 90.03 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.424 HG12 ' O ' ' B' ' 52' ' ' VAL . 26.2 mm -65.43 -52.3 53.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.445 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 83.2 mt-30 -52.7 -47.25 67.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.185 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 54.5 m170 -67.09 -44.88 78.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.283 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.6 tp -52.17 -27.49 14.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.319 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -52.16 -45.11 64.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.348 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -50.07 -28.45 7.16 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.708 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.87 -63.49 1.05 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 120.361 -0.536 . . . . 0.0 110.705 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.469 ' CG ' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -47.47 -46.35 26.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.38 0.609 . . . . 0.0 110.083 -179.74 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.469 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.2 t-20 -59.22 -36.75 75.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.055 -179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.1 tptp -60.81 -34.29 74.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.439 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 60.0 t -69.92 -51.24 41.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.523 0.678 . . . . 0.0 110.497 -179.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.481 ' O ' ' N ' ' B' ' 69' ' ' GLY . 5.4 mmmt -72.92 -21.75 60.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-O 122.564 1.173 . . . . 0.0 112.359 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 8.9 tpm_? -38.54 -27.94 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 114.489 -1.232 . . . . 0.0 110.685 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' B' ' 67' ' ' LYS . . . 155.27 66.67 0.01 OUTLIER Glycine 0 CA--C 1.522 0.513 0 N-CA-C 111.319 -0.712 . . . . 0.0 111.319 179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.447 ' OE1' HD12 ' B' ' 18' ' ' ILE . 60.3 mm-40 -112.4 -26.68 8.6 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 64.2 m -81.05 -8.12 59.7 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-O 121.021 0.439 . . . . 0.0 110.763 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.403 ' O ' ' N ' ' B' ' 74' ' ' GLU . 64.4 mttp -81.06 96.96 7.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.301 0.572 . . . . 0.0 110.079 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.445 ' O ' ' O ' ' B' ' 74' ' ' GLU . 0.5 OUTLIER -68.62 72.44 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.272 179.761 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.445 ' O ' ' O ' ' B' ' 73' ' ' LEU . 90.6 mt-10 -52.0 -105.26 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.648 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.417 ' CE1' ' CE1' ' B' ' 76' ' ' HIS . 78.5 t60 -139.59 111.16 7.15 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.482 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.417 ' CE1' ' CE1' ' B' ' 75' ' ' HIS . 1.7 m80 52.6 176.21 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.61 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -63.62 -41.05 98.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.35 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.469 ' O ' ' CG ' ' B' ' 79' ' ' HIS . 85.6 t60 -145.73 -83.58 0.13 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.554 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . 0.469 ' CG ' ' O ' ' B' ' 78' ' ' HIS . 77.9 m80 -157.52 -40.12 0.07 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.601 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.453 ' ND1' ' N ' ' B' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.502 0 CA-C-O 118.003 -0.999 . . . . 0.0 110.626 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.6 mmm . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.4 t -60.58 -43.28 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.31 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -51.68 147.34 6.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.588 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 tt 74.65 -59.24 0.56 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.643 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -59.56 -41.16 89.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.49 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -69.46 142.06 53.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.351 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.547 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 4.3 t -67.13 -42.4 40.43 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.107 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 68.2 Cg_exo -49.23 -24.37 8.12 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 C-N-CA 121.529 1.486 . . . . 0.0 112.125 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -70.14 -41.29 74.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.183 0.516 . . . . 0.0 110.449 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.414 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -62.81 -47.29 84.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.274 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 97.2 mt -63.11 -42.97 98.58 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.342 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -49.27 -25.15 2.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.717 -178.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 36.8 t-20 -75.63 -38.03 59.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.077 0.465 . . . . 0.0 110.599 178.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 43.6 mt -63.71 -39.33 94.03 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.548 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -55.32 -36.74 66.54 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.236 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.426 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.6 tt0 -65.77 -32.42 73.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.517 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.4 m-70 -66.69 -52.28 46.49 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.806 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 8.3 pt -73.96 -45.94 47.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.848 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 11.6 tm-20 -66.84 -50.37 62.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.426 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 4.1 tpp -94.79 -165.11 1.25 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.696 0.76 . . . . 0.0 109.934 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -154.56 44.11 0.52 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.257 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -56.98 -53.36 58.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.177 0.513 . . . . 0.0 110.286 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.0 p -174.73 70.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.385 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.71 -135.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.964 0.411 . . . . 0.0 110.204 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -156.57 -165.93 2.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.46 0.648 . . . . 0.0 109.928 -179.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.489 ' HZ3' HG12 ' A' ' 27' ' ' ILE . 17.9 ttpp -85.0 -103.23 0.05 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.451 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.532 ' C ' ' H ' ' A' ' 29' ' ' ALA . 3.3 mm -63.02 -38.99 83.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 -64.54 8.34 0.12 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.804 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.532 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.46 -48.47 22.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.458 179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.527 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.45 -43.94 96.33 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.277 179.917 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' ' SD ' ' A' ' 30' ' ' MET . 13.5 m120 -52.42 -46.18 66.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.323 -179.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -70.74 -54.88 10.09 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.806 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.414 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 44.5 t80 -58.88 -49.26 78.43 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.243 0.544 . . . . 0.0 110.669 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.794 ' O ' HG23 ' A' ' 38' ' ' VAL . 72.0 t80 -58.07 -48.47 80.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.904 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 60.9 ttp180 -66.74 -36.27 82.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.958 0.409 . . . . 0.0 110.41 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 19.2 t -62.77 -44.2 96.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.634 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 72.8 t -71.55 -51.83 30.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.374 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 34' ' ' TYR . 88.3 t -51.19 -48.81 31.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.246 -179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -60.45 -39.61 88.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.2 m -65.7 -48.19 72.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.271 0.557 . . . . 0.0 110.863 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.447 ' O ' ' O ' ' A' ' 44' ' ' ASP . 99.1 mt -56.91 -33.36 66.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.758 -179.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 99.4 t -87.34 -38.47 12.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.309 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -53.17 -12.84 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.664 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.447 ' O ' ' O ' ' A' ' 41' ' ' LEU . 3.4 m-20 -173.01 -172.88 0.88 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.178 0.513 . . . . 0.0 110.003 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 58.04 33.22 22.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.96 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 19.3 mt -81.63 44.33 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.452 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -64.31 -29.65 70.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.334 0.587 . . . . 0.0 110.702 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 87.8 tttt -168.22 131.3 1.52 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.713 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.661 HD22 ' N ' ' A' ' 50' ' ' ALA . 0.4 OUTLIER -48.42 -38.22 19.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.524 179.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.661 ' N ' HD22 ' A' ' 49' ' ' ASN . . . -67.05 -49.06 66.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.803 179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.5 t -51.83 -45.11 38.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.374 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.481 ' O ' HG12 ' A' ' 56' ' ' ILE . 35.4 m -77.79 -43.72 28.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.835 0.826 . . . . 0.0 111.116 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.433 ' N ' HG23 ' A' ' 52' ' ' VAL . 5.4 tt -63.69 -41.73 98.1 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.264 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -53.11 -40.01 63.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.987 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.435 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 53.1 mtp180 -67.51 -35.45 79.14 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 179.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 52' ' ' VAL . 40.9 mm -65.05 -51.11 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.58 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.598 ' NE2' HG11 ' B' ' 42' ' ' VAL . 98.1 mm-40 -57.65 -39.35 76.81 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.435 ' ND1' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -72.81 -46.37 53.49 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.089 0.471 . . . . 0.0 110.167 179.437 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.431 ' N ' ' CG ' ' A' ' 58' ' ' HIS . 29.5 tp -55.71 -25.02 38.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.631 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -59.39 -34.92 73.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.987 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.28 -32.24 72.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.955 0.407 . . . . 0.0 110.477 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.98 -54.27 13.99 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.81 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -46.71 69.21 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.966 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -62.49 -34.5 76.97 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.266 -179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 16.0 tptp -63.12 -37.85 88.87 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.404 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.8 t -57.86 -53.64 42.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.197 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 29.2 mtmt -64.69 -44.27 90.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.746 0.784 . . . . 0.0 111.4 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 74.1 ttt180 -53.87 -27.86 32.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.019 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -86.09 -15.05 65.6 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -95.52 174.41 7.02 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.106 0.479 . . . . 0.0 110.229 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 79.8 p -157.71 163.77 37.82 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.176 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -159.52 -19.4 0.07 Allowed 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.249 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -169.69 159.53 8.24 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 121.375 0.607 . . . . 0.0 110.353 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -128.69 -29.72 2.35 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.43 -179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -64.96 -170.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.783 0.325 . . . . 0.0 110.494 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 -147.79 142.14 26.29 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 121.143 0.497 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 26.3 p-80 -74.2 -16.96 60.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.452 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 81.1 t60 53.61 98.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.551 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -65.23 130.57 43.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.469 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 61.8 t-80 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.798 -179.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 52.9 m -156.28 165.46 36.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.548 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 56.3 59.13 3.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.379 0.609 . . . . 0.0 110.843 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.56 ' O ' ' N ' ' B' ' 6' ' ' SER . 4.0 mm? -66.24 -38.98 89.16 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.912 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.553 ' O ' ' CB ' ' B' ' 6' ' ' SER . 98.7 m-85 -46.59 88.7 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 122.256 1.027 . . . . 0.0 110.088 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.56 ' N ' ' O ' ' B' ' 4' ' ' LEU . 8.4 p 144.59 69.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.448 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.491 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.8 t -35.77 -54.66 1.31 Allowed Pre-proline 0 N--CA 1.481 1.104 0 C-N-CA 120.211 -0.595 . . . . 0.0 110.701 177.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 12.6 Cg_endo -51.42 -21.59 10.54 Favored 'Trans proline' 0 C--N 1.305 -1.757 0 C-N-CA 121.305 1.337 . . . . 0.0 112.331 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 6' ' ' SER . 16.8 t80 -64.98 -47.54 77.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.338 0.589 . . . . 0.0 110.713 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.9 OUTLIER -72.95 -47.54 44.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.359 -179.472 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 84.5 mt -58.79 -42.15 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.159 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 83.0 tt0 -47.42 -26.03 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.665 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . 0.431 ' ND2' ' NE2' ' B' ' 17' ' ' HIS . 54.3 t30 -74.08 -43.64 56.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.168 0.508 . . . . 0.0 110.464 179.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.9 mp -68.96 -36.42 77.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.896 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.45 ' NZ ' ' OE1' ' B' ' 19' ' ' GLU . 26.3 ttpp -58.78 -46.81 86.67 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.01 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -65.56 -29.05 69.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.578 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.431 ' NE2' ' ND2' ' B' ' 13' ' ' ASN . 5.7 m-70 -68.19 -52.7 31.47 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.686 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.403 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.4 pt -74.78 -46.2 41.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.014 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.45 ' OE1' ' NZ ' ' B' ' 15' ' ' LYS . 82.7 tt0 -56.0 -54.66 42.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.553 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 45.7 mtt -97.87 -137.53 0.28 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.866 0.365 . . . . 0.0 110.039 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -171.38 43.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.305 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -55.99 -47.84 76.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 -179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.3 p -173.9 68.53 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.318 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -166.9 -137.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.927 0.394 . . . . 0.0 110.422 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -156.27 -156.56 0.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.397 0.618 . . . . 0.0 109.891 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.403 ' O ' HG22 ' B' ' 18' ' ' ILE . 1.7 ttmp? -93.81 -103.07 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.978 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.462 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.1 mm -62.18 -39.36 83.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -67.77 7.56 0.49 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.653 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.462 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.75 -48.39 22.0 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.05 0.453 . . . . 0.0 110.651 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.631 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -64.68 -46.05 84.03 Favored 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.298 179.51 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.555 ' N ' ' SD ' ' B' ' 30' ' ' MET . 26.0 t-20 -51.18 -52.86 40.22 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.064 -0.655 . . . . 0.0 110.912 -178.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 10.8 t -60.64 -46.84 88.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.791 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 47.1 t80 -72.79 -20.03 61.24 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.623 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.631 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.0 t80 -73.79 -55.43 6.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.289 -178.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.37 -26.59 68.08 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.415 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 82.8 p -66.57 -46.56 75.63 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.35 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 55.8 t -70.18 -49.63 53.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.149 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 97.7 t -59.49 -49.28 84.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.361 -179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 19.5 m -65.5 -17.86 64.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.915 0.388 . . . . 0.0 110.633 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -87.32 -52.02 5.62 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.84 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 43' ' ' GLN . 97.8 mt -66.99 -40.92 87.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.609 -179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.662 ' O ' HG12 ' B' ' 42' ' ' VAL . 61.7 t -77.89 18.4 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.048 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . 0.405 ' H ' ' C ' ' B' ' 41' ' ' LEU . 75.6 mt-30 -145.13 -1.45 0.84 Allowed 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 120.727 0.299 . . . . 0.0 110.964 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -114.2 -30.61 6.58 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.491 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -152.24 86.83 1.3 Allowed 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.936 0.398 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.13 40.08 1.74 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.506 179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -62.81 -17.94 62.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.144 0.497 . . . . 0.0 110.401 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.682 ' O ' HG22 ' B' ' 51' ' ' VAL . 16.9 tptm -168.19 122.72 0.94 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.184 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -54.43 -15.98 2.01 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.049 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.436 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -80.31 -59.62 2.63 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 119.773 -0.771 . . . . 0.0 112.012 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.682 HG22 ' O ' ' B' ' 48' ' ' LYS . 23.1 m -45.93 -36.74 2.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.58 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.429 ' N ' HG23 ' B' ' 51' ' ' VAL . 32.7 m -77.53 -31.95 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.724 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' B' ' 50' ' ' ALA . 50.1 tp -58.05 -37.91 75.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.948 -178.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.466 ' C ' ' HE ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -58.89 -45.48 90.16 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.386 -179.129 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.564 ' HE ' ' N ' ' B' ' 55' ' ' ARG . 0.0 OUTLIER -64.3 -44.23 92.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.12 179.777 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 83.6 mt -63.38 -51.54 69.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.581 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -56.52 -44.45 80.8 Favored 'General case' 0 CA--C 1.511 -0.538 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 47.1 m170 -68.3 -42.09 79.94 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.6 tp -52.15 -26.03 10.39 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.741 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -58.39 -30.13 66.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.456 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -61.43 -36.75 81.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.889 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.43 -58.88 3.66 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.523 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.17 -44.22 61.45 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.026 0.441 . . . . 0.0 110.014 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -62.62 -40.92 98.49 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.306 -178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 57.2 tttm -66.96 -35.32 79.7 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.173 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 53.6 t -61.66 -49.99 82.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.161 0.505 . . . . 0.0 110.446 -179.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.89 -47.27 69.31 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 121.798 0.809 . . . . 0.0 111.582 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -63.84 -37.52 87.68 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.027 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.55 -26.9 72.2 Favored Glycine 0 CA--C 1.522 0.498 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -86.22 -46.72 10.11 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.746 0.307 . . . . 0.0 110.612 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 13.9 m -61.43 164.09 6.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.466 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 53.91 -137.57 1.2 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.391 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.501 HD12 ' N ' ' B' ' 73' ' ' LEU . 10.1 mp 41.33 -105.54 0.06 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.573 -179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' B' ' 73' ' ' LEU . 80.7 mm-40 33.34 -93.05 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.827 0.823 . . . . 0.0 110.524 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.63 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 43.2 t-80 58.46 -176.87 0.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.199 179.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.63 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 96.5 m-70 -135.42 42.46 2.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.29 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 84.5 t60 -79.38 77.66 5.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.956 0.407 . . . . 0.0 110.023 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.474 ' O ' ' N ' ' B' ' 80' ' ' HIS . 73.9 m80 52.62 71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 86.2 t60 53.9 -86.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.566 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.474 ' N ' ' O ' ' B' ' 78' ' ' HIS . 45.9 p-80 . . . . . 0 C--O 1.221 -0.437 0 CA-C-O 117.907 -1.044 . . . . 0.0 110.68 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.5 ttp . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.8 p -160.48 164.11 32.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.177 0.513 . . . . 0.0 110.477 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -135.51 76.85 1.64 Allowed 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.622 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.0 pp -171.44 3.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.87 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -61.01 -42.06 97.73 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.363 0.601 . . . . 0.0 110.317 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 t -52.52 127.67 23.41 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.466 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.58 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.5 t -51.69 -54.2 42.41 Favored Pre-proline 0 CA--C 1.54 0.59 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.58 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 7.9 Cg_endo -46.99 -16.65 0.32 Allowed 'Trans proline' 0 C--N 1.306 -1.698 0 C-N-CA 122.045 1.83 . . . . 0.0 112.099 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -70.65 -47.13 61.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.114 0.483 . . . . 0.0 110.691 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.431 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.0 m-85 -62.97 -42.51 99.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.465 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 93.9 mt -65.43 -43.62 94.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.286 0.565 . . . . 0.0 110.467 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -51.37 -26.27 7.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.436 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 -72.95 -36.63 67.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.123 0.487 . . . . 0.0 110.597 178.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.41 -38.88 85.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.452 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -58.34 -37.0 74.27 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.105 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.412 ' O ' ' CB ' ' A' ' 20' ' ' MET . 59.2 tt0 -65.71 -30.27 70.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.651 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.0 m170 -68.63 -52.75 27.98 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.68 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.54 -44.59 53.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.299 0.571 . . . . 0.0 110.965 179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.6 tp10 -67.79 -39.45 84.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.216 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.412 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 6.0 ttm -111.66 -163.21 0.84 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.529 0.68 . . . . 0.0 110.247 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -156.79 46.29 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.267 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -58.2 -49.46 76.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.176 0.512 . . . . 0.0 110.387 -179.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 30.0 p -176.21 69.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -165.45 -133.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.272 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -157.0 -165.38 1.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.246 0.546 . . . . 0.0 110.124 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -81.37 -108.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.258 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.558 HD13 ' OE2' ' A' ' 70' ' ' GLU . 5.8 tp -63.87 -35.71 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -63.53 5.83 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.577 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.526 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.1 -43.15 54.5 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.5 179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -62.6 -44.27 96.73 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 179.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' A' ' 30' ' ' MET . 29.9 m120 -52.49 -54.8 27.63 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.133 -0.627 . . . . 0.0 110.648 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.0 m -62.05 -55.25 31.0 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 119.765 -0.774 . . . . 0.0 110.931 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.431 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 55.1 t80 -57.23 -41.0 78.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.187 0.518 . . . . 0.0 110.596 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.43 ' O ' HG22 ' A' ' 38' ' ' VAL . 26.2 t80 -63.67 -52.37 60.99 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.989 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.526 HH12 ' CE ' ' B' ' 30' ' ' MET . 82.4 mtp180 -65.86 -27.14 68.01 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.2 p -72.0 -44.25 63.76 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.74 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.1 t -66.87 -63.11 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 C-N-CA 119.614 -0.835 . . . . 0.0 110.763 -179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.563 HG23 ' N ' ' A' ' 39' ' ' SER . 22.8 m -49.13 -45.84 17.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.338 -179.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.563 ' N ' HG23 ' A' ' 38' ' ' VAL . 64.7 p -58.42 -43.62 88.76 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.202 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.485 ' O ' ' N ' ' A' ' 44' ' ' ASP . 97.0 m -65.49 -46.84 78.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.058 0.456 . . . . 0.0 110.65 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.534 HD22 HH11 ' A' ' 55' ' ' ARG . 88.5 mt -63.65 -43.49 96.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.579 -179.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.596 HG12 ' O ' ' A' ' 42' ' ' VAL . 32.1 t -85.7 29.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.357 -179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.408 ' H ' ' H ' ' A' ' 44' ' ' ASP . 61.1 tp60 -160.68 -14.27 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.7 0.286 . . . . 0.0 110.796 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 40' ' ' THR . 31.4 t70 -114.37 -34.4 5.29 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.415 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -96.08 -79.59 0.44 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.543 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 56.4 mt 52.49 43.27 31.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.977 0.418 . . . . 0.0 110.576 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 8.8 t -88.65 -26.42 21.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.519 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 17.5 tptm -172.51 134.49 0.66 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.904 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 91.6 m-20 -54.72 -41.32 70.19 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.43 -45.47 87.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.298 -0.561 . . . . 0.0 111.016 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -55.08 -43.59 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.523 -179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 56' ' ' ILE . 34.1 m -76.5 -36.85 29.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.477 -0.489 . . . . 0.0 110.406 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 0.2 OUTLIER -59.94 -54.74 42.52 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.043 -0.663 . . . . 0.0 110.857 -177.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.33 -38.71 92.01 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.428 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.534 HH11 HD22 ' A' ' 41' ' ' LEU . 42.3 ttm180 -65.49 -42.1 92.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.496 179.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 52' ' ' VAL . 71.3 mt -65.47 -45.79 91.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.497 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -54.63 -36.5 64.59 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.439 ' ND1' ' OE2' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -66.47 -35.53 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 179.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.619 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -62.35 -40.24 95.74 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.522 -177.329 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -50.21 -29.88 10.36 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.32 -179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.439 ' OE2' ' ND1' ' A' ' 58' ' ' HIS . 4.9 pt-20 -60.34 -34.4 73.79 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.418 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.74 -49.26 26.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.954 0.407 . . . . 0.0 110.738 -179.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.86 -38.44 64.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.909 -179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -69.32 -36.86 77.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.62 -178.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.0 mmtt -60.19 -39.27 85.92 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.227 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.4 t -63.83 -47.32 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 122.041 0.924 . . . . 0.0 110.414 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 mmmt -61.46 -41.42 97.2 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 114.968 -1.014 . . . . 0.0 111.47 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 55.9 ttt85 -67.53 -14.21 62.73 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.108 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.59 -63.01 1.12 Allowed Glycine 0 N--CA 1.461 0.363 0 N-CA-C 110.654 -0.978 . . . . 0.0 110.654 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.595 ' CG ' ' H ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -50.17 -99.71 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.506 0.193 . . . . 0.0 110.742 -179.907 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.595 ' H ' ' CG ' ' A' ' 70' ' ' GLU . 41.8 t -65.32 90.79 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.398 0.618 . . . . 0.0 110.347 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 17.2 mmmt -60.35 -38.86 85.13 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.254 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.547 ' O ' ' N ' ' A' ' 75' ' ' HIS . 8.1 tp -141.8 -52.98 0.43 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.771 -179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.58 67.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.682 . . . . 0.0 110.763 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.547 ' N ' ' O ' ' A' ' 73' ' ' LEU . 85.7 t60 -106.21 59.75 0.65 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.3 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 54.33 79.89 0.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.727 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -77.56 -160.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.329 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 71.9 m80 54.82 173.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.471 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -73.73 151.26 40.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.518 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 . . . . . 0 C--O 1.22 -0.448 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.735 -179.78 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mmm . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 43.7 t -67.44 147.66 52.57 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.521 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -164.67 144.72 7.47 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.356 0.598 . . . . 0.0 110.444 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 49.3 tp -58.59 -29.03 66.12 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.089 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -54.19 -41.31 68.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.843 0.354 . . . . 0.0 110.211 -178.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 m -69.12 125.82 27.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.117 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.559 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.4 OUTLIER -64.93 -42.53 63.18 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.012 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 70.9 Cg_exo -51.95 -22.25 13.88 Favored 'Trans proline' 0 C--N 1.303 -1.826 0 C-N-CA 121.896 1.73 . . . . 0.0 111.984 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.5 t80 -61.91 -42.39 99.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.965 0.412 . . . . 0.0 110.28 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.437 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.2 OUTLIER -64.4 -38.12 89.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.192 -179.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.9 mt -64.23 -44.88 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 120.969 0.414 . . . . 0.0 110.506 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 -49.89 -22.54 1.54 Allowed 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.573 -179.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -69.7 -40.03 76.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.328 0.585 . . . . 0.0 110.553 179.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.04 -36.11 66.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.798 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -58.11 -32.83 68.48 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' B' ' 20' ' ' MET . 57.4 tt0 -75.13 -30.05 60.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.457 179.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 45.7 m170 -67.09 -51.44 54.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.752 0.31 . . . . 0.0 110.661 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.431 HG22 ' O ' ' B' ' 26' ' ' LYS . 9.5 pt -69.93 -41.82 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.497 0.665 . . . . 0.0 110.757 179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -73.68 -51.72 15.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.661 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.453 ' HG3' HE21 ' B' ' 22' ' ' GLN . 9.0 tpp -90.2 -66.57 0.91 Allowed 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 121.11 0.481 . . . . 0.0 110.583 -179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 4.0 t30 76.71 43.07 0.14 Allowed 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.797 179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.453 HE21 ' HG3' ' B' ' 20' ' ' MET . 90.8 mm-40 -55.25 -35.95 65.53 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.332 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 90.8 p -163.45 63.57 0.17 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.651 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -161.15 -132.82 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.39 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -153.21 -170.31 3.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.342 0.591 . . . . 0.0 110.316 -179.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.431 ' O ' HG22 ' B' ' 18' ' ' ILE . 59.7 tttp -80.96 -108.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.442 -179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.658 HD11 ' HD2' ' B' ' 67' ' ' LYS . 21.0 tt -62.22 -38.47 81.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.34 -179.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . 0.414 ' N ' HG23 ' B' ' 27' ' ' ILE . 80.7 m80 -58.48 -12.44 3.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.541 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.12 -41.62 49.0 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.522 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.545 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -65.38 -51.52 59.82 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.251 179.083 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.537 ' N ' ' SD ' ' B' ' 30' ' ' MET . 42.4 t30 -53.33 -37.28 62.16 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.243 -179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' B' ' 35' ' ' ARG . 79.5 p -76.73 -52.36 9.74 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 120.659 -0.416 . . . . 0.0 111.026 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.437 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 85.0 t80 -65.84 -38.16 88.14 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.398 0.618 . . . . 0.0 110.921 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.545 ' N ' ' O ' ' B' ' 30' ' ' MET . 58.6 t80 -62.08 -56.63 16.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.423 -179.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 32' ' ' SER . 36.9 ptt180 -60.47 -25.52 66.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.094 0.473 . . . . 0.0 110.16 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 71.1 m -73.19 -45.88 53.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.726 -179.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 42.4 t -67.45 -64.76 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 C-N-CA 119.655 -0.818 . . . . 0.0 110.362 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.502 HG23 ' N ' ' B' ' 39' ' ' SER . 19.4 m -45.41 -41.32 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.474 -179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.502 ' N ' HG23 ' B' ' 38' ' ' VAL . 14.0 t -60.26 -42.08 94.58 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -67.27 -46.12 74.62 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.401 0.619 . . . . 0.0 110.797 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.431 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.4 mm? -59.84 -37.0 78.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.215 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.1 t -80.77 -38.14 16.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.365 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -60.38 -11.69 7.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.655 -179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.431 ' O ' ' O ' ' B' ' 41' ' ' LEU . 79.2 m-20 -143.55 161.79 37.55 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-O 121.318 0.58 . . . . 0.0 110.229 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.4 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 47.9 tt0 73.47 162.19 0.26 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.997 179.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 178.26 25.02 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -63.02 -32.07 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.113 0.482 . . . . 0.0 110.404 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 17.2 tptm -170.67 123.73 0.65 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.786 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.648 HD22 ' N ' ' B' ' 50' ' ' ALA . 0.5 OUTLIER -47.26 -29.71 2.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.437 179.447 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.648 ' N ' HD22 ' B' ' 49' ' ' ASN . . . -73.8 -47.04 41.6 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.19 0.519 . . . . 0.0 110.694 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 7.1 t -50.22 -42.68 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.304 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.3 m -76.14 -33.47 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 4.7 tp -63.11 -40.85 98.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.43 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 36.8 pttt -53.0 -39.01 62.79 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.121 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -66.53 -40.75 89.3 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.132 -179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 65.0 mt -67.72 -50.94 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.297 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . 0.437 ' NE2' HG11 ' A' ' 42' ' ' VAL . 95.4 mm-40 -57.88 -39.21 77.28 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.43 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 6.1 m-70 -74.03 -38.13 64.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.109 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 45.6 tp -56.07 -30.59 62.2 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.516 -0.474 . . . . 0.0 110.582 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.468 ' O ' ' ND2' ' B' ' 64' ' ' ASN . 91.9 m-20 -52.47 -28.5 20.5 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.495 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -62.1 -35.27 78.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.799 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.01 -53.29 13.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.688 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.16 -45.82 72.15 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.018 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.468 ' ND2' ' O ' ' B' ' 60' ' ' ASP . 75.6 m-20 -63.45 -36.27 83.18 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.002 -178.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.412 ' HD2' HH21 ' B' ' 68' ' ' ARG . 34.5 tptt -61.37 -37.8 84.68 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.56 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.9 t -60.5 -58.22 8.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.284 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.658 ' HD2' HD11 ' B' ' 27' ' ' ILE . 16.4 mtmt -62.13 -47.04 86.35 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.66 0.743 . . . . 0.0 111.636 -179.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.412 HH21 ' HD2' ' B' ' 65' ' ' LYS . 55.5 ttp180 -56.03 -15.89 4.19 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.08 -179.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -96.81 -16.33 36.55 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.893 -0.883 . . . . 0.0 110.893 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -94.32 -58.44 2.21 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.656 0.265 . . . . 0.0 110.54 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 33.4 t -97.93 83.35 3.13 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.471 0.653 . . . . 0.0 110.474 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -171.08 -54.8 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.027 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 54.5 tp -124.14 132.23 53.62 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.58 0.705 . . . . 0.0 110.562 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -102.39 -6.79 22.6 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.507 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 37.5 m-70 58.8 15.92 4.13 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.999 0.428 . . . . 0.0 110.561 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 48.3 m170 47.91 -163.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.702 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -66.94 93.63 0.28 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.841 0.353 . . . . 0.0 110.444 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -71.49 125.96 28.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.404 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 59.5 t-80 -74.64 -76.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.567 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.484 ' CD2' ' H ' ' B' ' 80' ' ' HIS . 9.7 p80 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.553 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.5 mtp . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -63.93 -59.04 5.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.578 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 49.71 86.91 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.53 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 59.0 mt -66.62 128.64 37.02 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.115 0.483 . . . . 0.0 110.3 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -98.01 53.55 1.09 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.241 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 30.7 t 50.77 -136.51 1.26 Allowed 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.561 179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.48 ' N ' ' OG ' ' A' ' 6' ' ' SER . 3.0 t -58.79 -55.17 48.88 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-O 118.814 -0.612 . . . . 0.0 109.787 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 71.6 Cg_exo -34.04 -31.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.499 1.843 0 C-N-CA 121.633 1.555 . . . . 0.0 113.092 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 7' ' ' VAL . 53.3 t80 -63.65 -43.97 95.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.589 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 3.4 m-85 -61.59 -43.16 99.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.143 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -64.91 -49.01 81.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.418 0.628 . . . . 0.0 110.668 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -50.69 -25.11 3.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.401 -179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -73.65 -38.37 65.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.03 0.443 . . . . 0.0 110.258 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD1' ' A' ' 33' ' ' TYR . 44.5 mt -63.26 -39.43 94.57 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.435 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -59.89 -39.61 85.9 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.101 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -59.08 -26.8 64.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.565 -0.288 . . . . 0.0 110.531 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -73.97 -52.71 11.95 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.113 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -74.18 -43.66 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 CA-C-O 121.222 0.534 . . . . 0.0 110.706 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.429 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 67.5 mm-40 -67.33 -48.18 68.33 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.355 -179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 5.8 ttm -96.79 -161.03 0.84 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.373 0.606 . . . . 0.0 109.939 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -157.46 36.68 0.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.238 -179.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.4 mm100 -53.22 -66.81 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.997 0.427 . . . . 0.0 110.437 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 29.1 m -163.59 69.6 0.21 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.521 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.9 tp10 -159.94 -137.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.49 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -154.97 -168.67 2.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.262 0.553 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -81.21 -105.96 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.335 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.519 ' C ' ' H ' ' A' ' 29' ' ' ALA . 20.6 tt -65.29 -35.93 76.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.805 0.336 . . . . 0.0 110.455 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.404 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 49.3 t-80 -65.44 8.76 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.749 -179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -74.43 -43.88 54.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.328 179.394 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.59 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.3 -44.5 94.83 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.286 179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.59 ' N ' ' SD ' ' A' ' 30' ' ' MET . 42.4 t30 -52.05 -51.34 58.16 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.955 -0.698 . . . . 0.0 110.676 -178.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.0 t -65.16 -54.18 33.67 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.078 -0.649 . . . . 0.0 111.068 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 54.1 t80 -59.29 -43.64 92.54 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.322 0.582 . . . . 0.0 110.729 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.738 ' CE1' HG21 ' A' ' 38' ' ' VAL . 34.4 t80 -59.57 -56.79 17.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.175 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.608 ' NH2' ' CE2' ' B' ' 63' ' ' TYR . 72.8 ttt-85 -61.17 -28.34 69.06 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.166 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 69.2 m -68.69 -44.71 73.4 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.644 -0.423 . . . . 0.0 110.428 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 54.4 t -70.89 -55.71 13.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.285 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.738 HG21 ' CE1' ' A' ' 34' ' ' TYR . 98.1 t -52.93 -45.93 52.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.382 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.2 m -64.82 -21.86 66.87 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.383 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 95.3 m -86.29 -49.85 7.38 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.342 0.591 . . . . 0.0 111.018 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.485 HD22 ' NH1' ' A' ' 55' ' ' ARG . 86.5 mt -66.17 -43.58 86.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 -179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 42' ' ' VAL . 40.8 t -81.04 24.86 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.52 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -140.53 1.06 1.71 Allowed 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.445 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.44 ' O ' ' N ' ' A' ' 46' ' ' LEU . 44.9 t0 -146.97 167.33 24.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.318 0.58 . . . . 0.0 110.266 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 65.96 -64.4 0.2 Allowed 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.55 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' ' O ' ' A' ' 44' ' ' ASP . 18.9 mt 37.66 50.19 1.14 Allowed 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.193 0.52 . . . . 0.0 111.05 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -78.28 -30.45 48.49 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.694 -178.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 88.2 tttt -174.2 132.76 0.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.365 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.712 ' H ' HD22 ' A' ' 49' ' ' ASN . 0.8 OUTLIER -50.26 -41.17 49.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.375 0.607 . . . . 0.0 110.833 -179.683 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.424 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -62.83 -47.58 82.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.683 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 48.2 t -58.56 -47.42 88.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.269 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 32.0 t -67.89 -42.48 85.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.36 0.6 . . . . 0.0 110.627 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 63.9 tp -60.17 -43.14 96.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.399 -178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.77 -38.04 60.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.172 -179.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.485 ' NH1' HD22 ' A' ' 41' ' ' LEU . 60.4 mtp180 -67.44 -41.44 84.75 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.243 -178.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.454 HD12 HG22 ' A' ' 38' ' ' VAL . 33.7 mm -62.96 -51.1 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.478 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.4 mm-40 -54.98 -43.84 73.88 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.673 0.273 . . . . 0.0 110.382 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -68.56 -35.25 77.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.249 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 59' ' ' LEU . 0.3 OUTLIER -57.19 -39.78 76.08 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.379 -0.528 . . . . 0.0 110.281 -179.027 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 95.9 m-20 -51.19 -26.88 7.6 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.886 0.374 . . . . 0.0 110.387 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.41 -38.03 88.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.8 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.12 -53.39 11.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.911 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.01 -42.21 48.81 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-O 121.42 0.628 . . . . 0.0 109.935 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -63.95 -30.67 71.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.216 -179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.0 tptp -63.69 -36.86 85.23 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.488 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 66.5 t -66.17 -43.92 91.8 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 CA-C-O 121.933 0.873 . . . . 0.0 110.579 -178.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mmmt -63.12 -44.95 94.18 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.109 -179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -72.14 -12.33 61.14 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.048 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -93.73 -33.28 7.14 Favored Glycine 0 N--CA 1.475 1.299 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -90.84 -33.71 15.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 110.359 -179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 32.9 p -140.53 167.41 22.23 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.372 0.606 . . . . 0.0 110.75 179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -109.0 -13.57 14.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.693 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.6 tt 55.74 67.47 1.0 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.224 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -83.39 -88.15 0.1 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.175 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 74.6 t60 -151.95 147.4 26.51 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.718 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 78.7 m80 -147.49 -29.66 0.34 Allowed 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.591 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.4 m-70 -65.24 86.99 0.07 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.879 0.371 . . . . 0.0 110.503 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.417 ' O ' ' CG ' ' A' ' 79' ' ' HIS . 98.9 m-70 -56.99 -75.8 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.54 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' A' ' 78' ' ' HIS . 76.6 m80 -155.1 -49.4 0.09 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.584 -179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.518 -179.962 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . 0.485 ' O ' ' O ' ' B' ' 3' ' ' GLU . 70.7 m -68.63 -113.74 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.438 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.485 ' O ' ' O ' ' B' ' 2' ' ' SER . 97.7 mt-10 56.72 130.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.674 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.482 ' N ' HD12 ' B' ' 4' ' ' LEU . 10.3 mp 52.85 11.01 0.17 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.327 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.418 ' N ' ' C ' ' B' ' 3' ' ' GLU . 75.6 t80 -60.86 -46.24 91.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.149 0.499 . . . . 0.0 110.492 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -75.22 132.64 41.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.354 -179.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.533 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 38.3 t -65.8 -40.89 43.14 Favored Pre-proline 0 CA--C 1.538 0.519 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.026 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.533 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 71.4 Cg_exo -50.23 -13.26 0.63 Allowed 'Trans proline' 0 C--N 1.305 -1.736 0 C-N-CA 120.821 1.014 . . . . 0.0 112.198 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -73.11 -41.03 64.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.163 0.506 . . . . 0.0 110.59 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.427 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -73.21 -46.72 48.81 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.542 -179.809 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.82 -45.86 97.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.647 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -50.19 -20.97 1.15 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.257 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -66.91 -36.53 82.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.871 0.367 . . . . 0.0 110.519 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 4.7 mp -74.18 -35.94 64.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.621 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.38 -40.54 68.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.44 -179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' B' ' 20' ' ' MET . 51.3 tt0 -65.44 -35.29 80.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.253 179.524 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -63.19 -51.84 64.72 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.561 -0.456 . . . . 0.0 110.8 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.4 pt -73.83 -45.81 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 121.106 0.479 . . . . 0.0 110.747 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' B' ' 18' ' ' ILE . 10.7 tm-20 -67.09 -51.06 59.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.355 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.414 ' N ' ' O ' ' B' ' 16' ' ' GLN . 9.1 tpp -91.59 -156.28 0.45 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.5 0.667 . . . . 0.0 110.004 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 48.5 p-10 -164.74 41.51 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.202 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -57.33 -39.34 75.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.248 0.547 . . . . 0.0 110.592 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 3.6 t 174.45 70.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.321 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -164.54 -136.88 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.44 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 46.2 m-20 -157.16 -159.91 0.9 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.238 0.542 . . . . 0.0 110.39 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.444 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 63.2 tttm -91.0 -104.11 0.1 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.291 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.483 ' C ' ' H ' ' B' ' 29' ' ' ALA . 39.0 mm -62.47 -41.37 91.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.287 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' B' ' 28' ' ' HIS . 61.4 t-80 -62.08 2.18 0.25 Allowed 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.693 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.52 -46.53 54.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.61 0.243 . . . . 0.0 110.663 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.496 ' CE ' ' ND2' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -60.13 -42.64 95.26 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.174 179.494 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.496 ' ND2' ' CE ' ' B' ' 30' ' ' MET . 30.7 m120 -52.02 -50.84 60.6 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.788 -179.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 72.1 m -66.52 -56.16 12.16 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.963 -0.695 . . . . 0.0 110.962 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 80.7 t80 -56.58 -46.23 80.92 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.053 0.454 . . . . 0.0 110.605 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.438 ' CB ' ' O ' ' B' ' 30' ' ' MET . 79.5 t80 -57.87 -47.32 83.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.986 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 74.7 ttt-85 -71.16 -24.88 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.337 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 36.4 p -72.59 -47.83 44.73 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.46 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.78 -56.95 9.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.355 -0.538 . . . . 0.0 110.591 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -48.98 -45.54 16.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 69.3 m -60.7 -34.82 74.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.771 0.319 . . . . 0.0 110.304 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.8 m -74.15 -47.84 33.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.196 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -55.5 -36.12 66.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.21 -179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -81.55 -31.79 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.294 179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -124.12 82.73 2.06 Favored 'General case' 0 CA--C 1.512 -0.509 0 CA-C-O 121.549 0.69 . . . . 0.0 110.016 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -170.94 -67.03 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.944 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -102.06 -45.51 5.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.933 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 12.2 mt 44.04 60.82 2.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.747 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.9 t -92.84 -26.58 17.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.367 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.51 138.41 0.3 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.65 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -55.73 -43.1 76.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.162 0.506 . . . . 0.0 110.549 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.39 -43.06 97.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.637 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 49.0 t -60.92 -35.52 65.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.069 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 49.0 t -78.2 -44.44 27.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.425 0.631 . . . . 0.0 111.028 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.464 HD23 ' O ' ' B' ' 53' ' ' LEU . 1.1 tt -60.86 -51.99 66.97 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.857 -178.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptmm? -57.08 -39.88 75.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.264 0.554 . . . . 0.0 110.214 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -63.36 -37.88 88.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.336 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.8 mt -66.91 -46.53 84.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.37 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -55.87 -37.44 68.81 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.445 ' C ' ' ND1' ' B' ' 58' ' ' HIS . 1.4 t-80 -73.31 -37.35 66.2 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.67 ' O ' HD13 ' B' ' 59' ' ' LEU . 1.1 tm? -62.92 -39.96 96.15 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 119.969 -0.692 . . . . 0.0 110.78 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.403 ' O ' ' OD1' ' B' ' 64' ' ' ASN . 50.0 m-20 -50.43 -29.72 10.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.443 ' OE1' ' CD2' ' B' ' 58' ' ' HIS . 3.3 pt-20 -59.86 -33.07 71.31 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.669 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.24 -51.19 26.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 110.61 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.608 ' CE2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -53.34 -44.13 68.23 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.108 0.48 . . . . 0.0 109.766 -179.86 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.403 ' OD1' ' O ' ' B' ' 60' ' ' ASP . 22.6 m120 -64.48 -32.44 74.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 -178.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 14.1 tptp -60.39 -37.01 79.43 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.587 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 93.4 t -63.78 -46.29 94.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.724 0.773 . . . . 0.0 110.318 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.15 -47.19 52.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 122.183 0.992 . . . . 0.0 111.901 -179.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 82.0 mtp180 -60.51 -26.1 66.6 Favored 'General case' 0 CA--C 1.514 -0.435 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.139 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.22 -63.7 1.57 Allowed Glycine 0 C--N 1.33 0.213 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.477 ' OE1' ' N ' ' B' ' 71' ' ' SER . 2.1 pp20? -52.91 -173.65 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.719 0.295 . . . . 0.0 110.506 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.477 ' N ' ' OE1' ' B' ' 70' ' ' GLU . 1.0 OUTLIER 77.42 176.81 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.201 179.832 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.58 ' C ' HD23 ' B' ' 73' ' ' LEU . 51.6 mtmt 52.21 69.32 0.69 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.607 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.59 ' O ' ' N ' ' B' ' 75' ' ' HIS . 0.9 OUTLIER 34.56 29.57 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.33 0.586 . . . . 0.0 111.338 -179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' B' ' 72' ' ' LYS . 3.2 pt-20 -27.91 85.25 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.988 0.899 . . . . 0.0 111.193 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.604 ' CD2' ' H ' ' B' ' 76' ' ' HIS . 57.9 t60 -109.62 -133.02 0.33 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.496 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.604 ' H ' ' CD2' ' B' ' 75' ' ' HIS . 36.7 m80 -91.31 112.45 24.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.278 0.561 . . . . 0.0 110.624 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.448 ' O ' ' CG ' ' B' ' 78' ' ' HIS . 75.9 m80 -60.16 -41.97 93.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.385 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.448 ' CG ' ' O ' ' B' ' 77' ' ' HIS . 77.6 m80 -155.45 125.08 6.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.404 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 80.3 t60 -77.28 114.26 15.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.263 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 84.1 t60 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.392 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.4 m -87.43 2.87 49.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.415 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.427 ' C ' ' N ' ' A' ' 5' ' ' PHE . 74.2 mt-10 -72.76 58.33 0.45 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.954 0.406 . . . . 0.0 110.372 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.528 ' N ' HD22 ' A' ' 4' ' ' LEU . 3.8 mm? 52.85 10.78 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.585 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 3' ' ' GLU . 74.7 t80 -68.19 -29.57 68.45 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.398 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -72.83 133.73 44.58 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.312 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.599 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.5 t -72.5 -38.18 5.02 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.13 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.599 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 41.0 Cg_exo -56.35 -22.35 41.08 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 121.565 1.51 . . . . 0.0 111.892 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.46 ' CE1' HD11 ' A' ' 4' ' ' LEU . 39.2 t80 -60.64 -48.15 83.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.828 0.347 . . . . 0.0 110.285 -179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.75 -37.37 73.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.087 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.6 mt -67.94 -44.11 85.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.006 0.431 . . . . 0.0 110.526 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -51.95 -26.41 10.39 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.509 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -72.16 -30.92 65.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.968 0.413 . . . . 0.0 110.21 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.458 HD21 ' CD2' ' A' ' 33' ' ' TYR . 50.3 mt -68.83 -38.89 80.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.701 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -60.32 -34.13 73.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.091 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -66.33 -29.36 69.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.595 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 47.6 m170 -71.43 -53.52 13.75 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.78 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -69.91 -39.45 77.61 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-O 121.201 0.524 . . . . 0.0 110.755 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.28 -55.62 31.49 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.809 -179.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.442 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 69.0 mtm -107.51 -62.77 1.38 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 120.952 0.406 . . . . 0.0 110.328 179.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.443 ' OD1' ' N ' ' A' ' 25' ' ' ASP . 8.2 t30 83.56 51.56 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.795 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -48.19 -41.93 28.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.844 0.354 . . . . 0.0 110.513 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.3 m -160.83 65.87 0.31 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.593 179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.428 ' C ' HD21 ' A' ' 21' ' ' ASN . 20.2 tp10 -158.72 -134.73 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.418 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.443 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 73.4 m-20 -148.14 -166.22 2.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.188 0.518 . . . . 0.0 110.363 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -86.09 -110.03 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.196 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.543 HD11 ' HD2' ' A' ' 67' ' ' LYS . 17.9 tt -61.29 -33.63 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 120.797 0.332 . . . . 0.0 110.351 -179.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.644 ' CD2' HD22 ' A' ' 31' ' ' ASN . 46.4 t-80 -67.42 2.05 1.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.672 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.48 79.07 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.562 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.412 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -63.15 -43.86 97.12 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.269 -0.423 . . . . 0.0 109.89 179.82 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.644 HD22 ' CD2' ' A' ' 28' ' ' HIS . 43.8 t30 -53.69 -48.2 69.75 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.416 -0.514 . . . . 0.0 110.609 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.9 t -66.2 -53.57 35.71 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.504 -0.478 . . . . 0.0 110.86 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.458 ' CD2' HD21 ' A' ' 14' ' ' LEU . 64.1 t80 -61.0 -46.34 91.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.614 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.433 ' CE2' HD23 ' A' ' 59' ' ' LEU . 33.8 t80 -58.77 -42.36 88.77 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.487 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 75.6 ttt-85 -67.4 -31.21 71.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.896 0.379 . . . . 0.0 110.199 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.9 t -70.94 -42.69 69.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.784 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.1 t -67.32 -61.22 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 119.888 -0.725 . . . . 0.0 110.479 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.49 HG13 ' N ' ' A' ' 39' ' ' SER . 11.8 p -47.94 -40.88 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.074 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.49 ' N ' HG13 ' A' ' 38' ' ' VAL . 58.6 m -54.0 -47.49 71.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.508 179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 96.3 m -83.67 -32.49 25.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.664 179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.2 tt -56.35 -45.01 80.61 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.149 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.494 HG12 ' O ' ' A' ' 42' ' ' VAL . 77.8 t -68.48 -4.92 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.189 0.518 . . . . 0.0 110.529 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 55.9 tt0 -113.94 -39.89 3.86 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.802 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -46.83 -47.86 21.0 Favored 'General case' 0 CA--C 1.515 -0.384 0 CA-C-O 121.337 0.589 . . . . 0.0 110.097 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -103.15 -91.56 0.35 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.276 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 73.2 35.04 0.96 Allowed 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.986 0.422 . . . . 0.0 110.191 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.7 t -98.24 -23.84 15.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.354 0.597 . . . . 0.0 110.735 -179.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -167.04 131.65 1.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.753 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 52.3 m-20 -52.24 -34.72 47.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.285 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.03 -48.64 57.13 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.944 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.8 t -50.82 -42.75 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.693 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 34.7 m -76.28 -31.98 21.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.612 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 53' ' ' LEU . 0.2 OUTLIER -62.35 -47.56 83.66 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.673 -178.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.435 ' O ' ' CE1' ' A' ' 58' ' ' HIS . 2.1 ptpp? -63.36 -40.92 98.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.393 0.616 . . . . 0.0 110.157 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.403 ' N ' ' HG3' ' A' ' 54' ' ' LYS . 16.1 tpp180 -65.29 -43.58 90.71 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.27 -179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.6 mm -62.63 -44.47 99.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.085 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -55.09 -31.23 61.05 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.435 ' CE1' ' O ' ' A' ' 54' ' ' LYS . 2.5 m-70 -71.9 -36.5 70.03 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 18.6 tp -73.56 -29.09 62.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.471 ' O ' ' CD2' ' A' ' 63' ' ' TYR . 90.8 m-20 -52.53 -38.91 60.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.993 0.425 . . . . 0.0 110.322 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -66.84 -18.7 65.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.486 179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -67.13 -61.69 1.8 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.019 -179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.605 ' CD1' ' NH2' ' B' ' 35' ' ' ARG . 1.0 OUTLIER -56.01 -40.41 73.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 121.884 0.85 . . . . 0.0 110.154 -179.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.468 ' N ' ' CG ' ' A' ' 63' ' ' TYR . 52.2 t30 -62.83 -40.27 96.9 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.468 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -58.16 -42.68 86.47 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.2 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.482 ' O ' ' N ' ' A' ' 70' ' ' GLU . 72.7 t -62.88 -55.65 22.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.207 -179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.543 ' HD2' HD11 ' A' ' 27' ' ' ILE . 21.0 mtmt -63.15 -43.05 99.39 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.513 0.673 . . . . 0.0 111.336 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 59.0 ttt85 -66.79 -18.89 65.6 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.11 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 70' ' ' GLU . . . -107.86 -13.11 20.93 Favored Glycine 0 N--CA 1.464 0.554 0 N-CA-C 110.855 -0.898 . . . . 0.0 110.855 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.482 ' N ' ' O ' ' A' ' 66' ' ' VAL . 4.2 mm-40 -47.89 178.19 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.183 0.516 . . . . 0.0 110.657 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.567 ' O ' ' N ' ' A' ' 73' ' ' LEU . 39.1 t -63.6 81.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.471 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.7 mttp 60.93 -66.69 0.05 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.678 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.567 ' N ' ' O ' ' A' ' 71' ' ' SER . 4.8 tp 65.12 43.86 3.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.292 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -68.41 -59.65 3.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.313 0.578 . . . . 0.0 110.458 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.8 m170 53.99 100.83 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.445 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 61.8 m80 54.45 70.33 0.63 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.539 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -63.29 -42.18 99.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.519 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 61.3 t-80 -164.3 75.84 0.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.546 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -69.77 131.62 44.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.335 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 62.5 t-80 . . . . . 0 C--O 1.22 -0.478 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.662 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.8 mtt . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 12.3 m 53.01 14.0 0.42 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.583 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 76.6 tt0 -68.99 136.08 51.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.119 0.485 . . . . 0.0 110.224 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.454 ' C ' HD23 ' B' ' 4' ' ' LEU . 4.2 tt -78.55 107.9 11.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.471 0.653 . . . . 0.0 109.975 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -91.26 72.41 6.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.071 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p 46.61 -159.08 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.528 ' O ' ' N ' ' B' ' 9' ' ' TYR . 3.2 t -55.24 -54.97 44.62 Favored Pre-proline 0 CA--C 1.549 0.914 0 CA-C-O 118.903 -0.57 . . . . 0.0 109.808 179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 52.3 Cg_exo -34.3 -27.5 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 2.009 0 C-N-CA 121.7 1.6 . . . . 0.0 113.124 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.528 ' N ' ' O ' ' B' ' 7' ' ' VAL . 57.5 t80 -58.35 -37.77 75.84 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.304 179.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.438 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.5 OUTLIER -61.78 -43.18 99.36 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 74.7 mt -67.5 -46.95 82.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.84 0.828 . . . . 0.0 110.738 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -49.32 -23.14 1.29 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.63 -179.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . 0.414 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 18.5 m120 -74.93 -36.09 62.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.517 0.675 . . . . 0.0 110.595 179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' B' ' 14' ' ' LEU . 16.4 mt -69.13 -38.51 78.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.34 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -54.15 -39.98 67.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.165 -179.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -70.71 -31.81 68.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.238 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.469 ' O ' ' ND2' ' B' ' 21' ' ' ASN . 43.2 m170 -66.74 -50.41 62.84 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.704 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.3 pt -72.93 -36.16 50.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 CA-C-O 121.329 0.585 . . . . 0.0 110.656 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.2 tt0 -77.39 -54.65 6.19 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.069 -179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 18.8 tpp -81.77 -58.65 2.9 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-O 121.257 0.551 . . . . 0.0 110.54 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 17' ' ' HIS . 3.1 m120 69.5 36.76 2.13 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.866 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -60.28 -38.65 84.23 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.276 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 20.1 m -152.22 60.07 0.84 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.742 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tp10 -166.7 -133.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.139 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -158.44 -168.58 2.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.407 0.623 . . . . 0.0 110.358 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -85.8 -104.23 0.06 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.277 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.454 ' C ' ' H ' ' B' ' 29' ' ' ALA . 5.4 mm -61.31 -37.34 77.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -64.42 3.09 0.51 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.882 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.454 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -72.78 -46.81 51.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.828 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.407 ' O ' ' CB ' ' B' ' 34' ' ' TYR . 1.0 OUTLIER -62.5 -50.84 69.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.948 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -58.75 -48.04 82.57 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.447 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.6 t -65.34 -53.79 38.54 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.546 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.438 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 39.5 t80 -60.11 -53.14 61.27 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.078 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.414 ' O ' HG22 ' B' ' 38' ' ' VAL . 55.1 t80 -53.44 -42.06 66.72 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.605 ' NH2' ' CD1' ' A' ' 63' ' ' TYR . 73.0 ttt-85 -68.55 -35.17 77.05 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 37.2 t -64.6 -43.0 95.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.486 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.47 ' O ' ' N ' ' B' ' 41' ' ' LEU . 62.2 t -67.1 -65.35 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.304 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.594 HG23 ' N ' ' B' ' 39' ' ' SER . 29.9 m -47.64 -49.43 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.7 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.594 ' N ' HG23 ' B' ' 38' ' ' VAL . 34.2 p -47.48 -61.09 2.09 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 119.994 -0.682 . . . . 0.0 111.401 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.6 m -74.62 -44.18 51.84 Favored 'General case' 0 N--CA 1.475 0.788 0 CA-C-O 122.273 1.035 . . . . 0.0 111.03 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.47 ' N ' ' O ' ' B' ' 37' ' ' VAL . 51.3 tp -57.31 -34.44 68.72 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.688 -1.142 . . . . 0.0 110.579 -179.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.561 HG23 ' O ' ' B' ' 38' ' ' VAL . 53.6 t -75.65 -2.28 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.9 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -155.58 41.04 0.4 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.401 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -99.12 -59.45 1.72 Allowed 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.101 0.477 . . . . 0.0 110.389 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -113.19 -31.97 6.45 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.528 -179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 tt 48.79 68.02 0.77 Allowed 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 121.257 0.551 . . . . 0.0 110.163 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.2 t -96.49 -25.34 15.69 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.298 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -180.0 140.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.688 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -61.97 -44.77 96.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.489 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.04 -40.76 86.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.738 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 9.0 t -57.93 -62.04 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 119.781 -0.767 . . . . 0.0 110.704 -179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 25.5 m -54.03 -33.82 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.484 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.434 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.29 -61.72 2.21 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 120.224 -0.59 . . . . 0.0 111.048 -178.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -55.32 -34.67 64.4 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 120.761 -0.375 . . . . 0.0 110.206 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -65.34 -39.57 92.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 86.5 mt -67.65 -49.97 65.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.335 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -56.52 -38.28 71.63 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.479 ' CE1' ' OE1' ' B' ' 61' ' ' GLU . 34.0 t60 -69.78 -43.29 72.47 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.32 -27.5 47.49 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.488 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -53.29 -36.71 61.49 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.435 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.479 ' OE1' ' CE1' ' B' ' 58' ' ' HIS . 5.8 pt-20 -57.72 -31.27 66.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.387 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.43 -58.13 4.05 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.79 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.3 -40.71 49.37 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.032 0.444 . . . . 0.0 109.933 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -68.98 -36.62 78.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.578 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 24.2 mmtm -65.05 -35.77 82.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.616 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 77.6 t -57.24 -52.92 50.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.09 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 37.8 mtmt -69.69 -38.4 76.98 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 122.012 0.911 . . . . 0.0 111.664 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -40.85 -32.84 0.25 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.394 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.93 -44.76 5.91 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.492 -1.043 . . . . 0.0 110.492 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -65.3 152.4 43.87 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.056 0.455 . . . . 0.0 110.035 -179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.587 ' O ' ' N ' ' B' ' 73' ' ' LEU . 22.9 t -166.59 36.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.288 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt 60.67 -42.47 0.11 Allowed 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 121.651 0.738 . . . . 0.0 111.511 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.587 ' N ' ' O ' ' B' ' 71' ' ' SER . 86.8 mt -67.92 -34.03 75.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.362 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' B' ' 76' ' ' HIS . 76.2 mm-40 53.17 64.5 1.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.313 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -62.61 81.95 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.389 -179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.435 ' O ' ' N ' ' B' ' 78' ' ' HIS . 69.4 m80 -63.96 -44.58 92.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.32 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 43.1 m170 48.14 -92.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.552 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.435 ' N ' ' O ' ' B' ' 76' ' ' HIS . 83.0 t60 48.42 71.82 0.33 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.626 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 52.83 79.84 0.11 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.658 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' B' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.627 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.7 mmm . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.411 ' OG ' ' N ' ' A' ' 3' ' ' GLU . 26.5 t 53.22 -152.57 0.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.739 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.411 ' N ' ' OG ' ' A' ' 2' ' ' SER . 42.6 tt0 -159.27 90.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.624 0.726 . . . . 0.0 110.68 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -87.02 6.17 33.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -56.47 -43.74 79.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.197 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -64.29 131.43 47.3 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.023 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.585 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.9 t -65.84 -40.47 39.32 Favored Pre-proline 0 CA--C 1.534 0.34 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.124 178.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 49.9 Cg_exo -54.19 -26.61 43.19 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 121.79 1.66 . . . . 0.0 112.066 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -61.19 -41.05 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.281 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.432 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.6 m-85 -60.38 -39.39 87.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.364 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 55.3 mt -67.79 -45.27 84.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.979 0.419 . . . . 0.0 110.461 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -48.2 -23.99 1.03 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.529 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 68.3 m-20 -74.48 -33.79 62.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 110.685 179.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.58 -37.51 68.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.314 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -57.26 -41.08 79.0 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.993 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.562 HE21 HE21 ' A' ' 22' ' ' GLN . 56.4 tt0 -67.95 -31.29 70.92 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.543 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -66.17 -50.69 63.05 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.024 0.44 . . . . 0.0 110.819 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.8 pt -70.92 -39.94 75.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.25 0.548 . . . . 0.0 110.83 179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -57.59 -53.86 53.44 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.252 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 72.8 mtm -114.49 -118.82 0.31 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.404 179.652 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -171.67 61.65 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.377 -179.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.562 HE21 HE21 ' A' ' 16' ' ' GLN . 8.1 tp-100 -73.41 50.35 0.31 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 122.105 0.955 . . . . 0.0 110.96 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 76.79 55.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.136 179.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.4 tp10 -156.51 -134.68 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 121.21 0.528 . . . . 0.0 110.614 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -159.38 -169.29 2.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.21 -179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.7 tttm -80.71 -105.18 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.356 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.456 ' C ' ' H ' ' A' ' 29' ' ' ALA . 6.9 tt -65.71 -31.12 52.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.53 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 80.9 m80 -69.86 10.33 0.41 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.557 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.56 -45.18 22.38 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.358 0.599 . . . . 0.0 110.872 179.204 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.507 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.9 ptm -62.01 -50.76 70.76 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.401 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -53.61 -46.91 70.59 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.197 -0.601 . . . . 0.0 110.397 -178.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -67.05 -53.6 29.59 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.381 -0.527 . . . . 0.0 111.055 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.432 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 47.4 t80 -62.4 -49.63 74.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.385 0.612 . . . . 0.0 110.99 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.507 ' N ' ' O ' ' A' ' 30' ' ' MET . 75.9 t80 -54.56 -47.94 72.63 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.07 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -65.25 -38.1 89.29 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.4 p -59.89 -43.41 94.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.401 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 98.0 t -70.89 -49.55 49.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.468 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 37.5 t -49.6 -49.25 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.396 -179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.8 t -59.02 -35.92 74.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.817 0.341 . . . . 0.0 110.452 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 90.1 m -71.66 -49.77 36.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.412 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -49.74 -34.26 18.52 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.877 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 57.9 t -86.21 -33.48 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.5 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.458 ' O ' ' CB ' ' A' ' 44' ' ' ASP . 84.3 mt-30 -111.33 81.63 1.47 Allowed 'General case' 0 CA--C 1.503 -0.855 0 CA-C-O 121.989 0.9 . . . . 0.0 109.736 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.458 ' CB ' ' O ' ' A' ' 43' ' ' GLN . 3.6 t70 156.94 136.44 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.204 178.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.431 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 56.4 tt0 69.21 -62.23 0.41 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.871 178.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt 45.56 70.59 0.35 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.058 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 t -101.25 -28.9 12.39 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.302 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' HE3' ' HB3' ' A' ' 50' ' ' ALA . 34.5 ttpt -178.17 144.83 0.34 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.232 -179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.91 -41.96 97.15 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.664 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.564 ' HB3' ' HE3' ' A' ' 48' ' ' LYS . . . -58.37 -46.18 86.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 116.333 -0.394 . . . . 0.0 109.982 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.4 -64.86 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.74 -178.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.432 HG23 ' N ' ' A' ' 53' ' ' LEU . 31.9 m -53.8 -39.69 40.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.602 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.432 ' N ' HG23 ' A' ' 52' ' ' VAL . 57.4 tp -60.43 -52.27 65.94 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.733 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.4 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 49.5 mtpt -52.07 -37.02 52.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.568 -179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 23.8 mmt85 -66.48 -34.28 77.59 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.181 179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 95.7 mt -71.81 -52.77 23.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.779 -0.369 . . . . 0.0 110.354 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -58.76 -32.98 69.77 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.141 -179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.4 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -77.12 -46.91 21.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.091 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.6 tp -52.23 -27.16 13.77 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.612 -0.435 . . . . 0.0 110.44 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -51.26 -38.35 52.21 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.397 -179.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -54.71 -33.02 60.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.588 179.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -54.49 16.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.549 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.461 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -53.29 -44.81 68.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.141 0.496 . . . . 0.0 110.318 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -65.83 -35.56 81.02 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.961 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -62.32 -40.01 94.93 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.416 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 99.1 t -62.65 -48.81 86.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.455 0.645 . . . . 0.0 110.467 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -44.14 92.38 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 122.414 1.102 . . . . 0.0 111.698 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -55.77 -27.67 52.15 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 114.586 -1.188 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -83.63 -8.5 84.58 Favored Glycine 0 CA--C 1.518 0.262 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 61.6 mm-40 -122.44 -135.88 0.3 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 110.299 -0.26 . . . . 0.0 110.299 -179.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.509 ' OG ' ' N ' ' A' ' 72' ' ' LYS . 5.5 p 69.42 -63.12 0.39 Allowed 'General case' 0 CA--C 1.513 -0.454 0 CA-C-O 122.371 1.081 . . . . 0.0 110.674 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.509 ' N ' ' OG ' ' A' ' 71' ' ' SER . 71.8 mmtt 72.4 113.94 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.24 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 46.9 mt 60.95 -136.86 0.6 Allowed 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.767 179.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 53.86 73.7 0.37 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.118 0.485 . . . . 0.0 110.474 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 39.2 p-80 -102.07 23.65 11.25 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.391 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.474 ' CD2' ' O ' ' A' ' 78' ' ' HIS . 4.1 t60 -138.93 134.34 33.05 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.162 0.506 . . . . 0.0 110.749 179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 50.2 m-70 -62.92 -88.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.681 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.474 ' O ' ' CD2' ' A' ' 76' ' ' HIS . 54.5 t-80 -72.93 150.25 42.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.523 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.414 ' CG ' ' N ' ' A' ' 80' ' ' HIS . 84.6 t60 -71.0 160.26 33.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.487 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.414 ' N ' ' CG ' ' A' ' 79' ' ' HIS . 59.3 t-80 . . . . . 0 C--O 1.219 -0.53 0 CA-C-O 118.134 -0.936 . . . . 0.0 110.627 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 78.4 p -67.33 -16.96 64.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.37 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 81.1 mm-40 -53.84 153.54 4.6 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.626 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.442 ' CD1' ' CD1' ' B' ' 9' ' ' TYR . 4.3 mm? -46.4 114.37 0.8 Allowed 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 121.751 0.786 . . . . 0.0 110.417 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -73.64 64.47 0.9 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.224 -0.898 . . . . 0.0 109.747 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 43.7 t 55.6 -163.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.739 179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.486 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 2.7 t -57.4 -54.92 49.8 Favored Pre-proline 0 CA--C 1.541 0.612 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.148 178.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 50.2 Cg_exo -35.06 -29.13 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.72 0 C-N-CA 122.117 1.878 . . . . 0.0 113.081 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.472 ' N ' ' O ' ' B' ' 7' ' ' VAL . 41.0 t80 -56.22 -41.85 76.3 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.018 -179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.403 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.8 m-85 -62.11 -40.23 95.18 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 36.3 mt -64.86 -48.78 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-O 121.295 0.569 . . . . 0.0 110.343 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.85 -26.49 35.71 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.311 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . 0.451 ' ND2' ' O ' ' B' ' 9' ' ' TYR . 4.5 m120 -69.49 -35.57 75.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.872 0.368 . . . . 0.0 110.235 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.516 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -68.3 -36.92 80.08 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.635 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -56.42 -32.54 64.96 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.033 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.428 ' O ' ' N ' ' B' ' 20' ' ' MET . 1.9 pt20 -67.25 -35.06 78.76 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.378 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 32.8 m170 -65.33 -50.74 64.5 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 120.523 -0.471 . . . . 0.0 110.505 -177.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.8 pt -73.36 -41.73 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.564 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 83.5 tt0 -72.07 -53.77 11.86 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.781 -179.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.428 ' N ' ' O ' ' B' ' 16' ' ' GLN . 24.8 ttm -86.47 -69.06 0.7 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.106 0.479 . . . . 0.0 110.349 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.416 ' OD1' ' N ' ' B' ' 25' ' ' ASP . 43.2 t30 74.93 45.03 0.16 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.706 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -40.04 -34.35 0.28 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.461 0.648 . . . . 0.0 111.097 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.1 p -167.09 -20.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.659 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -61.42 -132.52 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.917 0.389 . . . . 0.0 110.593 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' B' ' 21' ' ' ASN . 69.1 m-20 -155.79 -166.29 2.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.351 0.596 . . . . 0.0 110.099 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 37.9 ttmt -83.41 -101.81 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.793 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.558 ' C ' ' H ' ' B' ' 29' ' ' ALA . 46.7 mm -65.66 -39.69 85.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.186 179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . 0.472 ' CD2' ' O ' ' B' ' 28' ' ' HIS . 73.2 t60 -65.64 11.38 0.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 121.004 -0.278 . . . . 0.0 110.508 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.558 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -75.92 -49.25 18.35 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 120.938 0.399 . . . . 0.0 110.475 179.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.594 ' O ' ' N ' ' B' ' 34' ' ' TYR . 0.0 OUTLIER -58.01 -39.93 79.52 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.258 179.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.565 ' N ' ' SD ' ' B' ' 30' ' ' MET . 93.2 m-20 -49.75 -40.4 40.91 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.406 -176.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 22.3 t -80.12 -55.92 4.59 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.619 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.516 ' CD1' HD21 ' B' ' 14' ' ' LEU . 63.4 t80 -58.18 -46.6 85.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.085 0.469 . . . . 0.0 110.887 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.594 ' N ' ' O ' ' B' ' 30' ' ' MET . 28.9 t80 -57.22 -51.52 68.99 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.897 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.461 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 74.9 ttt180 -67.08 -25.94 66.48 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.7 m -70.9 -46.95 61.64 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.566 -179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.443 ' O ' ' N ' ' B' ' 40' ' ' THR . 77.8 t -64.95 -65.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.63 -179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.596 HG23 ' N ' ' B' ' 39' ' ' SER . 23.6 m -45.69 -46.23 4.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.537 -179.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.596 ' N ' HG23 ' B' ' 38' ' ' VAL . 42.0 t -59.67 -26.58 65.66 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.695 179.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . 0.458 ' O ' ' N ' ' B' ' 44' ' ' ASP . 28.9 m -85.22 -51.12 6.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.779 179.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.88 -45.05 91.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.78 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.416 HG23 ' O ' ' B' ' 38' ' ' VAL . 69.7 t -58.23 -22.1 18.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.078 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -103.8 -26.79 12.58 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.577 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' B' ' 40' ' ' THR . 51.3 t0 -56.74 -47.4 80.13 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.207 0.527 . . . . 0.0 110.766 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -133.38 -167.09 1.87 Allowed 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.313 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 179.1 31.89 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.578 -179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.438 HG22 ' H ' ' B' ' 47' ' ' THR . 0.0 OUTLIER -62.91 -45.49 92.24 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.264 0.554 . . . . 0.0 110.284 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.3 tptt -156.89 133.0 9.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -50.24 -25.3 3.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.617 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.612 ' C ' ' HZ2' ' B' ' 54' ' ' LYS . . . -78.16 -53.4 7.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.075 0.464 . . . . 0.0 110.948 179.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 23.3 t -46.04 -39.52 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.286 -179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.0 m -77.05 -32.01 19.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.25 0.547 . . . . 0.0 110.599 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 38.1 tp -59.95 -29.83 68.68 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.259 -179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.612 ' HZ2' ' C ' ' B' ' 50' ' ' ALA . 28.5 mmtm -62.03 -46.7 88.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.453 0.644 . . . . 0.0 110.525 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -64.95 -42.74 94.36 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.399 -179.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 78.4 mt -62.8 -50.1 81.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.451 179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -54.33 -35.76 63.04 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.499 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' O ' ' B' ' 54' ' ' LYS . 8.9 m-70 -72.36 -22.3 61.17 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.419 HD22 ' HA ' ' B' ' 59' ' ' LEU . 0.2 OUTLIER -76.42 -23.97 53.98 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.347 179.611 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -62.4 -41.67 98.85 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.452 -179.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' B' ' 58' ' ' HIS . 7.9 pt-20 -61.77 -31.47 71.67 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.947 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.93 -57.86 4.53 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.532 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.54 -42.97 55.9 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 121.511 0.672 . . . . 0.0 110.212 -179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -63.43 -33.72 76.17 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.765 -178.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 32.1 tptt -64.4 -38.1 89.85 Favored 'General case' 0 N--CA 1.444 -0.754 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.441 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 89.7 t -61.01 -48.33 89.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.464 0.65 . . . . 0.0 110.4 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -48.21 50.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 122.211 1.005 . . . . 0.0 111.692 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 79.3 mmt-85 -59.46 -35.17 73.56 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.106 -179.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.44 -16.56 75.68 Favored Glycine 0 CA--C 1.519 0.334 0 N-CA-C 110.584 -1.006 . . . . 0.0 110.584 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -97.1 -171.32 2.19 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.047 0.451 . . . . 0.0 110.583 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 37.3 t -166.01 166.67 17.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.252 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 27.1 mtpp -74.44 -55.49 5.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.534 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.488 ' O ' ' N ' ' B' ' 75' ' ' HIS . 2.2 pp -155.39 -26.79 0.11 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.016 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -50.44 89.21 0.0 OUTLIER 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.918 0.866 . . . . 0.0 109.984 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.488 ' N ' ' O ' ' B' ' 73' ' ' LEU . 47.2 t-80 60.23 72.49 0.52 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.297 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 85.9 t60 -157.45 76.59 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.632 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 40.5 m80 -146.06 156.95 43.82 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.449 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -69.65 128.84 37.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.385 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -77.4 140.15 39.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.409 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 47.6 t-80 . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.1 -0.952 . . . . 0.0 110.763 -179.975 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.1 mtt . . . . . 0 N--CA 1.489 1.48 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.5 t 69.03 -56.32 0.54 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.522 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 52.9 91.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.43 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 4' ' ' LEU . 0.6 OUTLIER -170.67 -21.36 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.854 0.359 . . . . 0.0 110.552 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -62.48 -45.65 92.04 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.227 0.537 . . . . 0.0 110.218 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 m -76.03 131.76 39.71 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.234 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.654 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 57.2 t -65.04 -48.25 71.36 Favored Pre-proline 0 CA--C 1.539 0.542 0 CA-C-N 116.013 -0.54 . . . . 0.0 109.835 178.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 9.0 Cg_endo -47.34 -23.64 3.35 Favored 'Trans proline' 0 N--CA 1.499 1.831 0 C-N-CA 121.636 1.557 . . . . 0.0 112.296 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -62.32 -43.69 98.24 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 121.04 0.448 . . . . 0.0 110.491 -179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.6 OUTLIER -61.4 -41.93 97.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.103 -179.835 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 31.4 mt -60.27 -44.2 95.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.288 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -52.12 -23.95 6.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.753 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -66.58 -38.4 86.97 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.5 mp -73.51 -36.94 65.82 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.812 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 29.4 tptt -52.95 -32.99 48.97 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 121.143 0.497 . . . . 0.0 110.406 -179.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' MET . 58.5 tt0 -68.95 -33.67 74.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.603 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 45.8 m170 -63.57 -51.86 63.54 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.616 -179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.401 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 9.0 pt -73.96 -45.48 48.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.291 0.567 . . . . 0.0 110.952 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 80.1 tt0 -67.61 -38.87 84.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.263 -179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.422 ' CB ' ' O ' ' A' ' 16' ' ' GLN . 5.7 ttm -111.04 -164.07 0.89 Allowed 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 121.596 0.713 . . . . 0.0 110.253 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -154.83 45.36 0.52 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.36 -179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -56.55 -46.01 80.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.129 0.49 . . . . 0.0 110.408 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t 176.81 67.72 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.397 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -161.35 -133.72 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 110.358 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -156.69 -168.67 2.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.185 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.486 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 60.9 tttp -80.34 -104.85 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.552 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.7 tt -64.86 -35.46 75.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.65 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -67.44 12.39 0.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.623 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.519 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -77.93 -45.73 23.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.118 0.485 . . . . 0.0 110.585 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -61.06 -43.94 98.12 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.526 -179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' A' ' 30' ' ' MET . 26.4 t-20 -50.25 -40.33 47.52 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.493 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -78.59 -55.42 5.21 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 120.321 -0.551 . . . . 0.0 110.755 179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 78.8 t80 -59.49 -48.92 79.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.188 0.518 . . . . 0.0 110.681 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.655 ' O ' HG23 ' A' ' 38' ' ' VAL . 64.7 t80 -54.56 -44.39 72.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.859 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -71.28 -28.02 63.84 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 28.9 m -70.03 -48.02 59.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.037 0.446 . . . . 0.0 110.711 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 82.4 t -71.26 -45.26 71.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.466 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.2 t -55.26 -42.48 66.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.29 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 77.5 p -64.5 -25.9 68.2 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 120.78 0.324 . . . . 0.0 110.498 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 94.4 m -84.21 -45.69 12.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.718 179.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.468 HD22 ' HG2' ' A' ' 55' ' ' ARG . 92.8 mt -58.92 -43.06 91.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.867 -179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 p -70.79 -27.37 30.31 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 121.463 0.649 . . . . 0.0 110.931 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.529 ' O ' ' C ' ' A' ' 44' ' ' ASP . 66.4 mt-30 -86.04 -28.44 24.14 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.629 -179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.529 ' C ' ' O ' ' A' ' 43' ' ' GLN . 77.0 m-20 -24.96 -81.77 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.964 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.514 ' O ' ' N ' ' A' ' 47' ' ' THR . 10.4 pt20 -156.55 7.68 0.2 Allowed 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.051 0.453 . . . . 0.0 110.627 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.477 ' C ' ' O ' ' A' ' 45' ' ' GLN . 1.0 OUTLIER 27.93 39.85 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.486 0.66 . . . . 0.0 111.075 -178.906 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.514 ' N ' ' O ' ' A' ' 45' ' ' GLN . 9.8 t -60.53 -29.92 69.42 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.588 -178.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -157.99 126.31 5.45 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.58 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.401 ' CG ' ' ND2' ' B' ' 49' ' ' ASN . 17.1 p30 -46.74 -35.82 6.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.198 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.68 70.37 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.888 0.375 . . . . 0.0 110.697 179.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.2 t -52.56 -45.07 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.642 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -79.35 -41.16 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.114 0.483 . . . . 0.0 110.925 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 58.5 tp -64.68 -48.52 74.44 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.079 -0.648 . . . . 0.0 111.052 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.42 -43.58 93.01 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.802 0.81 . . . . 0.0 110.411 -178.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.468 ' HG2' HD22 ' A' ' 41' ' ' LEU . 19.5 tpt85 -63.35 -37.03 85.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.129 -179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.25 -45.18 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.423 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.419 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.99 -36.62 72.89 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.381 -179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 56.6 m170 -72.63 -43.5 63.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.34 179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 37.1 tp -53.56 -30.43 41.93 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.748 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -51.77 -29.2 17.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.495 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -60.96 -32.51 72.04 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.497 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.3 -56.56 5.78 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.729 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.6 -44.99 66.36 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.976 0.417 . . . . 0.0 110.121 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.74 -35.53 80.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.0 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -57.34 -42.78 82.61 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.457 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 93.7 t -62.8 -49.68 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-O 121.536 0.684 . . . . 0.0 110.484 -179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.97 -43.38 92.81 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.82 0.819 . . . . 0.0 111.523 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.7 tpt180 -60.05 -23.3 63.63 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.109 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.41 -17.85 20.73 Favored Glycine 0 N--CA 1.465 0.597 0 N-CA-C 110.969 -0.852 . . . . 0.0 110.969 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.486 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 5.8 mm-40 -107.61 169.29 8.68 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.354 0.597 . . . . 0.0 110.323 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 52.2 p 45.52 92.33 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.759 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.5 mtmm -67.9 -95.27 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.483 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.521 ' N ' HD12 ' A' ' 73' ' ' LEU . 9.5 mp -74.09 147.87 42.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 0.0 109.916 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -138.05 54.76 1.79 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.212 -179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 -66.81 -65.88 0.62 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.292 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.488 ' CG ' ' N ' ' A' ' 77' ' ' HIS . 76.3 t60 51.51 -109.38 0.43 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.516 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.488 ' N ' ' CG ' ' A' ' 76' ' ' HIS . 63.9 t-80 -72.42 128.11 34.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.035 0.445 . . . . 0.0 110.38 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -90.44 119.43 30.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.299 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.457 ' O ' ' CG ' ' A' ' 80' ' ' HIS . 99.0 m-70 -60.91 -69.55 0.23 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.591 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.457 ' CG ' ' O ' ' A' ' 79' ' ' HIS . 74.0 m80 . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 117.994 -1.003 . . . . 0.0 110.448 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.492 ' SD ' ' N ' ' B' ' 1' ' ' MET . 4.4 mpp? . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 35.2 t -167.56 9.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.371 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.414 ' N ' ' CD ' ' B' ' 3' ' ' GLU . 1.3 pm0 -158.63 77.4 0.76 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.613 0.721 . . . . 0.0 110.845 -179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -99.97 27.27 5.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.148 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -59.61 -47.3 86.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 120.959 0.409 . . . . 0.0 109.931 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -76.47 131.15 38.87 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.161 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.632 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -55.77 -50.53 86.6 Favored Pre-proline 0 CA--C 1.539 0.549 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.807 178.65 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.632 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 5.7 Cg_endo -44.62 -17.49 0.15 Allowed 'Trans proline' 0 C--N 1.305 -1.719 0 C-N-CA 121.987 1.792 . . . . 0.0 112.217 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.437 ' N ' ' O ' ' B' ' 7' ' ' VAL . 81.0 t80 -69.28 -43.01 74.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.154 0.502 . . . . 0.0 110.433 -179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -68.21 -46.09 71.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.659 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.409 ' O ' ' N ' ' B' ' 14' ' ' LEU . 40.6 mt -62.8 -43.61 98.91 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 CA-C-O 121.086 0.47 . . . . 0.0 110.29 -179.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -46.34 -21.96 0.21 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.205 -179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . 0.416 ' O ' ' CD2' ' B' ' 17' ' ' HIS . 46.4 m-20 -73.03 -39.29 66.08 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.905 0.383 . . . . 0.0 110.363 179.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.611 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.3 mp -71.13 -37.01 72.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.64 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -55.98 -42.31 76.1 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.323 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -66.92 -31.63 72.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.434 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.416 ' CD2' ' O ' ' B' ' 13' ' ' ASN . 45.1 m170 -66.98 -51.73 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.156 0.503 . . . . 0.0 110.672 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.1 pt -74.11 -43.69 51.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.833 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.4 tp10 -68.7 -53.61 21.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 8.5 tpp -88.15 -157.87 0.44 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.5 0.666 . . . . 0.0 109.992 179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -157.74 46.28 0.36 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.321 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.5 tt0 -63.03 -51.98 64.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.252 0.549 . . . . 0.0 110.497 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.7 p -174.91 72.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.421 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -166.52 -136.2 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.991 0.424 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -157.44 -158.1 0.72 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.138 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.481 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 64.1 tttm -94.91 -103.01 0.15 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.431 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 1.6 mm -61.59 -36.71 75.06 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -70.64 4.86 2.16 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.613 -179.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -73.98 -50.24 20.81 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.723 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.543 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -61.46 -43.52 98.73 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.253 179.486 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.543 ' N ' ' SD ' ' B' ' 30' ' ' MET . 15.0 m120 -53.71 -48.46 69.55 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.329 -0.548 . . . . 0.0 110.587 -179.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 t -66.91 -53.22 34.16 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.818 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 57.0 t80 -61.79 -50.06 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.26 0.553 . . . . 0.0 110.849 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.642 ' O ' HG23 ' B' ' 38' ' ' VAL . 75.1 t80 -54.71 -45.52 74.03 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.722 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -68.62 -37.0 79.4 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 120.906 0.384 . . . . 0.0 110.617 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 55.2 m -61.96 -44.18 97.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.217 0.532 . . . . 0.0 110.772 -179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 77.7 t -72.05 -46.27 59.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.597 179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.642 HG23 ' O ' ' B' ' 34' ' ' TYR . 38.0 t -50.47 -44.98 25.31 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.446 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.351 -179.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 10.7 t -63.39 -34.64 78.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 120.839 0.352 . . . . 0.0 110.191 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.7 m -72.61 -49.92 28.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.143 0.497 . . . . 0.0 110.936 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.441 ' CD2' ' NH2' ' B' ' 55' ' ' ARG . 97.3 mt -50.91 -34.93 30.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.948 -179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 98.5 t -87.77 -32.81 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.441 179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -119.72 82.58 1.91 Allowed 'General case' 0 CA--C 1.507 -0.706 0 CA-C-O 121.527 0.68 . . . . 0.0 110.176 -179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -167.64 -71.22 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.998 178.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.644 ' NE2' HH12 ' B' ' 55' ' ' ARG . 5.2 pt20 -105.54 -38.35 6.48 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.342 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.0 tp 37.85 54.19 1.56 Allowed 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.787 -179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.424 ' H ' HG22 ' B' ' 47' ' ' THR . 2.5 t -83.89 -24.79 30.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.868 -179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.405 ' O ' HG23 ' B' ' 52' ' ' VAL . 35.6 tptt -173.78 138.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.751 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.536 ' ND2' ' N ' ' B' ' 50' ' ' ALA . 2.1 p-10 -54.59 -46.15 73.71 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.624 -0.431 . . . . 0.0 110.808 179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.536 ' N ' ' ND2' ' B' ' 49' ' ' ASN . . . -58.66 -45.7 88.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.432 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 48.9 t -57.67 -34.34 47.28 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.364 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.005 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.405 HG23 ' O ' ' B' ' 48' ' ' LYS . 39.3 t -81.89 -45.07 20.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 121.591 0.71 . . . . 0.0 111.1 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -52.35 65.5 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.907 -177.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.437 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.2 pttp -53.36 -40.58 65.06 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.416 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.644 HH12 ' NE2' ' B' ' 45' ' ' GLN . 77.3 mtp180 -68.34 -37.28 80.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.118 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 4.3 mm -64.38 -50.65 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.459 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -61.39 -37.22 82.61 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.255 -179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.496 ' CE1' ' OE2' ' B' ' 61' ' ' GLU . 5.7 t-80 -67.55 -46.98 71.16 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 120.888 0.375 . . . . 0.0 110.233 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 35.7 tp -49.88 -30.43 10.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.685 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -52.21 -30.83 29.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.7 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.496 ' OE2' ' CE1' ' B' ' 58' ' ' HIS . 9.5 pt-20 -58.1 -36.32 72.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.602 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.43 -53.47 28.83 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 120.836 0.35 . . . . 0.0 110.475 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.1 -46.28 72.04 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.172 0.511 . . . . 0.0 110.193 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.476 ' ND2' ' CZ ' ' B' ' 68' ' ' ARG . 49.9 t30 -63.75 -36.67 84.65 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.315 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 30.5 tptt -60.26 -33.6 72.53 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.222 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.61 -43.15 94.06 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 122.028 0.918 . . . . 0.0 110.515 -178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.406 ' HZ3' ' HB3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -69.0 -44.77 72.13 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.655 -179.116 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.476 ' CZ ' ' ND2' ' B' ' 64' ' ' ASN . 87.2 mtm180 -66.82 -21.93 66.02 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.336 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.443 ' O ' ' N ' ' B' ' 72' ' ' LYS . . . -89.69 -70.1 1.24 Allowed Glycine 0 N--CA 1.463 0.453 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.481 ' OE1' ' NZ ' ' B' ' 26' ' ' LYS . 2.7 pp20? -37.82 -38.82 0.31 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.686 0.755 . . . . 0.0 111.464 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.403 ' N ' ' CD ' ' B' ' 70' ' ' GLU . 74.2 m -50.53 -38.98 47.69 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.013 179.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.443 ' N ' ' O ' ' B' ' 69' ' ' GLY . 68.8 mttm -134.47 -163.04 1.31 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.069 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 22.4 tp 48.89 70.2 0.49 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.641 -179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -111.9 -2.67 15.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.54 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.455 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 55.7 t-80 54.23 12.28 0.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.901 0.382 . . . . 0.0 110.438 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.491 ' ND1' ' N ' ' B' ' 76' ' ' HIS . 0.3 OUTLIER -72.95 134.33 44.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.395 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 47.99 92.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.74 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.487 ' CD2' ' H ' ' B' ' 80' ' ' HIS . 79.6 t60 -160.26 141.75 12.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.47 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -59.45 -44.77 92.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.52 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . 0.487 ' H ' ' CD2' ' B' ' 78' ' ' HIS . 85.0 t60 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.977 -1.011 . . . . 0.0 110.696 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -139.76 149.38 43.5 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.443 ' OE1' ' N ' ' A' ' 3' ' ' GLU . 40.1 mp0 -90.14 111.09 22.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.638 0.732 . . . . 0.0 110.325 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.77 12.57 33.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.248 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.4 t80 -58.19 -45.29 87.85 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.936 0.398 . . . . 0.0 110.159 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.7 137.88 44.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.18 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.577 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.4 OUTLIER -67.66 -41.8 32.16 Favored Pre-proline 0 CA--C 1.537 0.472 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.868 179.162 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 52.4 Cg_exo -52.85 -24.82 25.25 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 C-N-CA 122.02 1.814 . . . . 0.0 111.92 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -61.62 -47.2 86.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.842 0.353 . . . . 0.0 110.331 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.448 ' CD1' ' OH ' ' A' ' 33' ' ' TYR . 2.9 m-85 -59.41 -40.47 86.75 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.293 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 41.9 mt -64.71 -43.99 96.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-O 121.032 0.444 . . . . 0.0 110.295 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -52.02 -25.76 9.23 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.735 -179.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -73.21 -35.46 66.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.269 0.557 . . . . 0.0 110.621 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 14.0 mt -70.55 -37.37 74.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.323 -179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -52.28 -39.67 60.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.069 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -65.01 -31.86 73.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.586 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 35.6 m170 -67.32 -51.95 46.26 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.697 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 10.9 pt -72.95 -44.32 57.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.848 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 80.4 tt0 -53.94 -55.34 27.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.45 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 58.2 mtm -113.11 -133.34 0.34 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.921 0.391 . . . . 0.0 110.202 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 48.3 p30 -171.48 52.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.332 -179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -45.08 74.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.491 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -174.56 62.16 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -166.17 -133.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.399 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -157.39 -162.95 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.094 0.473 . . . . 0.0 110.325 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.406 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 64.2 tttm -83.44 -104.95 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.356 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.528 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.8 mt -66.11 -37.42 79.72 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 -179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 76.1 m80 -63.69 6.47 0.15 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.612 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.528 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -78.16 -45.8 22.28 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.466 179.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.573 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -60.61 -44.85 95.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.479 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.573 ' N ' ' SD ' ' A' ' 30' ' ' MET . 39.2 t30 -51.63 -50.69 59.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.557 -178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 74.0 m -65.51 -53.38 43.15 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.358 -0.537 . . . . 0.0 110.633 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.448 ' OH ' ' CD1' ' A' ' 10' ' ' PHE . 4.9 t80 -61.46 -23.46 65.89 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.872 0.368 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.536 ' N ' ' O ' ' A' ' 30' ' ' MET . 82.8 t80 -76.74 -57.61 3.76 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.376 0.608 . . . . 0.0 110.953 -178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -23.81 66.84 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.646 -0.706 . . . . 0.0 109.979 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 93.0 p -71.2 -49.88 38.91 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.541 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 79.8 t -70.8 -56.35 11.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.316 -0.402 . . . . 0.0 109.934 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 89.2 t -49.97 -48.04 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.501 -179.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 58.2 m -54.96 -52.29 63.5 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.195 -0.602 . . . . 0.0 110.798 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 20.0 m -68.92 -44.17 73.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.754 0.788 . . . . 0.0 110.981 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.542 HD13 ' O ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -59.72 -40.69 88.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.432 -178.784 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 42' ' ' VAL . 26.5 t -96.0 26.87 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.515 -0.379 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.106 -179.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -165.9 27.77 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -154.54 17.48 0.46 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.705 0.288 . . . . 0.0 110.541 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.407 ' HG2' ' H ' ' A' ' 47' ' ' THR . 57.1 tt0 -153.38 -77.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.359 -179.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.405 HD11 HE22 ' B' ' 57' ' ' GLN . 4.8 tp 59.41 41.41 19.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.207 0.527 . . . . 0.0 110.642 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.407 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 33.8 m -70.85 -40.49 72.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.51 0.671 . . . . 0.0 110.966 -179.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 63.7 tttp -175.53 143.15 0.61 Allowed 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.627 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.565 ' ND2' ' HB2' ' B' ' 50' ' ' ALA . 65.7 m-20 -50.08 -45.93 52.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.724 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.4 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -64.07 -46.91 82.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.256 -0.578 . . . . 0.0 110.706 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 49.9 t -57.02 -47.23 83.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.863 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.557 HG23 ' N ' ' A' ' 53' ' ' LEU . 15.9 m -76.55 -46.65 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.66 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.557 ' N ' HG23 ' A' ' 52' ' ' VAL . 60.0 tp -51.3 -58.6 5.76 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 120.338 -0.545 . . . . 0.0 110.884 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.472 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 17.5 pttm -50.5 -35.63 30.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.851 -179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 tpt85 -66.34 -44.7 82.54 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.199 -179.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 50.6 mm -63.57 -52.51 56.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.618 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.487 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -56.61 -39.4 73.54 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.472 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -68.99 -44.0 73.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.273 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 21.1 tp -60.2 -33.68 72.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.87 0.367 . . . . 0.0 110.434 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -51.4 -39.55 57.48 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.541 -179.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -58.75 -29.16 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.345 179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.11 -54.0 21.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.773 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -54.7 -43.06 72.19 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.158 0.504 . . . . 0.0 110.118 179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -66.07 -37.37 85.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.621 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' O ' ' N ' ' A' ' 69' ' ' GLY . 2.5 mmpt? -62.0 -34.58 76.45 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.239 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.58 -46.04 96.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 CA-C-O 121.363 0.602 . . . . 0.0 110.153 -179.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -67.96 -42.84 80.27 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.497 -179.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 54.1 ttt85 -80.67 -10.41 59.73 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.151 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 65' ' ' LYS . . . -97.66 -26.12 10.15 Favored Glycine 0 N--CA 1.471 0.973 0 N-CA-C 111.128 -0.789 . . . . 0.0 111.128 -179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.436 ' OE2' HD11 ' A' ' 27' ' ' ILE . 1.5 pp20? -88.17 -31.69 19.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.893 0.377 . . . . 0.0 110.329 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.48 ' OG ' ' N ' ' A' ' 72' ' ' LYS . 40.4 t -106.87 -167.79 1.33 Allowed 'General case' 0 N--CA 1.472 0.675 0 CA-C-O 121.246 0.546 . . . . 0.0 110.579 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.48 ' N ' ' OG ' ' A' ' 71' ' ' SER . 1.3 ptpp? -159.68 69.17 0.42 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.462 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.8 tp 55.71 64.7 1.66 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.553 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -148.91 98.37 2.84 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.368 0.604 . . . . 0.0 110.127 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.446 ' O ' ' O ' ' A' ' 76' ' ' HIS . 25.6 p80 -168.34 134.46 1.9 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.468 179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.586 ' CD2' ' H ' ' A' ' 78' ' ' HIS . 23.4 t-160 56.15 116.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.769 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -56.18 -42.32 76.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.429 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.586 ' H ' ' CD2' ' A' ' 76' ' ' HIS . 22.1 t-160 53.37 103.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.542 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 98.3 m-70 -64.75 135.43 55.82 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.504 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 . . . . . 0 C--O 1.22 -0.452 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.605 -179.912 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 84.1 mtp . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 26.0 t 52.25 98.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.628 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -154.01 159.8 41.76 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.559 -179.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.406 ' C ' HD23 ' B' ' 4' ' ' LEU . 1.9 tt -70.86 103.12 2.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.407 0.622 . . . . 0.0 110.158 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -102.25 78.6 1.77 Allowed 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.107 179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.452 ' OG ' ' N ' ' B' ' 7' ' ' VAL . 46.6 t 53.35 -164.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.845 179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' B' ' 9' ' ' TYR . 2.9 t -56.01 -55.59 39.84 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.515 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 46.6 Cg_exo -34.82 -26.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.305 -1.747 0 C-N-CA 122.052 1.835 . . . . 0.0 113.126 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.533 ' N ' ' O ' ' B' ' 7' ' ' VAL . 89.8 t80 -56.65 -40.07 74.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.356 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.23 -45.39 91.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.072 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.57 -43.99 83.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.319 0.581 . . . . 0.0 110.384 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 79.9 tt0 -50.59 -25.86 4.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.507 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -76.08 -34.54 59.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.246 0.546 . . . . 0.0 110.496 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 23.8 mt -73.25 -40.03 64.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.537 -179.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.3 tttp -58.42 -37.11 74.69 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.997 -179.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.424 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.4 tt0 -66.59 -41.43 88.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.524 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 31.8 m170 -59.08 -49.55 77.45 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.451 -0.499 . . . . 0.0 110.858 -179.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.8 pt -73.31 -40.67 57.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.618 179.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -72.06 -60.42 2.24 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 120.144 -0.623 . . . . 0.0 110.964 -179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.53 ' SD ' ' N ' ' B' ' 20' ' ' MET . 0.0 OUTLIER -81.43 -66.29 0.91 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.76 HD21 ' N ' ' B' ' 25' ' ' ASP . 7.2 t-20 75.46 46.84 0.11 Allowed 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -54.32 -41.35 68.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.008 0.432 . . . . 0.0 110.583 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 38.2 t -161.63 66.09 0.26 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.601 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . 0.443 ' OE2' ' CB ' ' B' ' 32' ' ' SER . 29.2 tp10 -158.03 -127.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.394 179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.76 ' N ' HD21 ' B' ' 21' ' ' ASN . 62.3 m-20 -160.68 -172.41 3.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.239 0.543 . . . . 0.0 110.109 -179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -83.38 -103.47 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.288 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 45.7 mm -63.04 -34.11 64.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.738 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 m80 -64.57 -5.56 5.8 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.28 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.6 -49.95 71.35 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.969 0.414 . . . . 0.0 110.682 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.533 ' O ' ' N ' ' B' ' 34' ' ' TYR . 12.2 tmm? -56.45 -48.35 77.25 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.797 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -52.83 -39.47 62.5 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.513 -0.475 . . . . 0.0 110.388 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.443 ' CB ' ' OE2' ' B' ' 24' ' ' GLU . 7.9 t -73.36 -54.5 8.17 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.116 -0.633 . . . . 0.0 110.773 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.409 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 38.0 t80 -63.08 -25.07 68.2 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 121.082 0.467 . . . . 0.0 110.973 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.721 ' O ' HG23 ' B' ' 38' ' ' VAL . 29.7 t80 -72.82 -51.27 19.55 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.367 -179.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.532 HH22 ' CG ' ' A' ' 31' ' ' ASN . 19.7 ptp180 -72.48 -20.52 61.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.54 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.8 t -70.8 -54.25 12.34 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.71 -178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.511 HG23 ' N ' ' B' ' 38' ' ' VAL . 30.2 m -69.04 -43.39 81.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.35 179.61 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.721 HG23 ' O ' ' B' ' 34' ' ' TYR . 48.3 t -49.97 -51.64 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.46 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.412 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 88.5 p -56.76 -45.91 81.75 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 120.789 -0.365 . . . . 0.0 110.493 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 93.6 m -68.31 -48.37 65.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.073 0.463 . . . . 0.0 110.873 179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 78.0 mt -58.12 -45.78 86.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.515 -179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 73.2 t -69.41 -40.15 79.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 59.0 tt0 -70.56 -29.33 65.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.758 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.901 ' O ' ' O ' ' B' ' 45' ' ' GLN . 38.5 m-20 -103.69 -150.39 0.42 Allowed 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.831 -179.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.901 ' O ' ' O ' ' B' ' 44' ' ' ASP . 46.2 tt0 34.13 130.44 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.942 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -154.51 87.74 1.18 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.625 0.726 . . . . 0.0 109.727 -179.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 2.1 t -141.26 -27.45 0.69 Allowed 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.344 179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -179.21 141.54 0.17 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 0.0 111.091 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.468 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 15.9 p30 -59.9 -38.5 82.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.577 179.292 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.565 ' HB2' ' ND2' ' A' ' 49' ' ' ASN . . . -64.32 -39.97 94.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.426 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 38.0 t -61.42 -62.7 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.537 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 29.1 m -50.52 -31.99 9.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.34 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 51.4 tp -69.73 -42.2 74.29 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.34 0.591 . . . . 0.0 110.895 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.474 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 24.1 pttt -53.48 -37.29 62.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.217 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.64 ' HE ' HE22 ' B' ' 45' ' ' GLN . 92.3 mtt-85 -65.15 -30.46 71.38 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.348 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 20.8 mm -74.52 -46.78 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.33 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . 0.405 HE22 HD11 ' A' ' 46' ' ' LEU . 93.5 mt-30 -64.47 -24.57 67.66 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.08 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.474 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 1.6 m-70 -65.63 -50.47 64.89 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.479 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 86.2 mt -47.58 -20.34 0.25 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.631 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' B' ' 58' ' ' HIS . 81.6 m-20 -52.29 -45.45 65.52 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.376 -0.53 . . . . 0.0 110.381 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.401 ' CG ' ' N ' ' B' ' 62' ' ' ALA . 8.2 pt-20 -62.82 -41.13 99.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.998 0.428 . . . . 0.0 110.529 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . 0.401 ' N ' ' CG ' ' B' ' 61' ' ' GLU . . . -71.96 -47.14 54.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.891 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -50.78 -42.69 58.15 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 121.102 0.477 . . . . 0.0 109.84 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -67.78 -36.31 80.24 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.551 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 21.2 mmtp -62.58 -40.86 98.22 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.35 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 98.9 t -59.75 -50.49 79.85 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 C-N-CA 120.271 -0.571 . . . . 0.0 110.253 -179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -51.19 18.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 122.078 0.942 . . . . 0.0 111.749 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -56.52 -36.13 68.84 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 115.01 -0.995 . . . . 0.0 109.859 -179.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -71.37 -9.27 67.94 Favored Glycine 0 CA--C 1.521 0.425 0 N-CA-C 110.656 -0.978 . . . . 0.0 110.656 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 73.3 mm-40 -108.01 -174.26 2.48 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.131 0.491 . . . . 0.0 110.428 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 30.4 t -166.98 36.1 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.42 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 65.3 mttp 46.97 28.35 0.86 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.877 0.37 . . . . 0.0 110.516 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 42.4 tp -57.71 -53.59 56.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.183 0.516 . . . . 0.0 110.679 -179.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 55.18 77.22 0.22 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.661 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' B' ' 77' ' ' HIS . 1.0 OUTLIER -133.47 -12.79 2.69 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.535 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.461 ' O ' ' CE1' ' B' ' 78' ' ' HIS . 8.6 m80 68.54 -56.97 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.922 0.392 . . . . 0.0 110.498 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.418 ' N ' ' O ' ' B' ' 75' ' ' HIS . 76.9 m-70 54.32 88.77 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.307 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.461 ' CE1' ' O ' ' B' ' 76' ' ' HIS . 66.5 m80 -145.53 147.62 32.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.588 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 53.01 176.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.684 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.644 179.985 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 tpt . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.4 p -167.53 88.92 0.3 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.602 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 -129.5 61.33 1.55 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.594 0.712 . . . . 0.0 111.097 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.91 ' H ' HD22 ' A' ' 4' ' ' LEU . 0.4 OUTLIER -83.87 74.62 10.19 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.579 179.07 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -63.58 -38.93 93.0 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.055 179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.1 p -82.88 127.21 33.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.249 -179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.587 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 2.1 t -67.33 -39.17 18.89 Favored Pre-proline 0 CA--C 1.539 0.548 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.998 178.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -52.93 -21.67 16.25 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 C-N-CA 121.896 1.731 . . . . 0.0 112.087 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.539 ' CD2' HD12 ' A' ' 4' ' ' LEU . 79.3 t80 -65.22 -43.86 90.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.092 0.472 . . . . 0.0 110.635 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.454 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -64.01 -44.27 93.11 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.584 -179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.46 HD13 ' HD3' ' A' ' 65' ' ' LYS . 25.1 mt -66.77 -42.26 89.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.519 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -49.42 -26.06 3.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.251 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -71.13 -33.34 70.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.924 0.393 . . . . 0.0 110.402 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.402 ' N ' ' O ' ' A' ' 11' ' ' ILE . 36.4 mt -72.15 -37.41 69.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.594 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -54.48 -38.98 67.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.136 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -65.55 -35.6 81.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.451 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -62.09 -51.42 67.99 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.654 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.41 HG13 ' N ' ' A' ' 19' ' ' GLU . 13.4 pt -74.45 -43.91 48.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.179 0.514 . . . . 0.0 111.025 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.41 ' N ' HG13 ' A' ' 18' ' ' ILE . 82.2 tt0 -64.73 -52.15 58.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.543 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 35.7 mtt -104.75 -161.92 0.85 Allowed 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.198 0.523 . . . . 0.0 110.022 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -150.78 47.91 0.86 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.38 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -57.14 -49.58 75.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.517 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 38.4 p -175.45 68.6 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.496 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -167.12 -134.85 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.4 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -158.35 -166.25 1.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.121 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -80.91 -106.07 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.552 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.549 HD11 ' HD2' ' A' ' 67' ' ' LYS . 20.3 tt -64.57 -37.14 79.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 120.954 0.407 . . . . 0.0 110.568 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -64.85 9.79 0.08 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.588 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -75.07 -42.64 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.103 0.478 . . . . 0.0 110.593 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -62.01 -47.05 86.52 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.166 179.753 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.676 ' ND2' ' HE ' ' B' ' 35' ' ' ARG . 36.8 t-20 -51.9 -43.71 63.46 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.193 -0.603 . . . . 0.0 110.481 -178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.8 m -71.11 -54.11 12.25 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.959 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.454 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 49.5 t80 -61.25 -43.79 98.3 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.746 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.474 ' O ' HG23 ' A' ' 38' ' ' VAL . 39.2 t80 -58.56 -47.97 82.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.797 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.45 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 81.3 mtp180 -69.16 -27.67 65.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.376 179.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.7 t -66.46 -46.68 75.58 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.541 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 94.1 t -68.28 -45.87 81.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.513 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 34' ' ' TYR . 53.5 t -51.87 -47.85 40.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.411 -179.394 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 t -57.32 -42.66 82.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.435 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.9 m -64.88 -45.28 86.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.941 0.4 . . . . 0.0 110.746 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 89.6 mt -58.58 -47.17 85.17 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.614 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.5 t -71.68 -38.33 66.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.781 0.325 . . . . 0.0 110.43 179.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -71.76 -33.28 68.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.637 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 1.129 ' O ' ' O ' ' A' ' 45' ' ' GLN . 30.5 m-20 -74.59 173.83 9.88 Favored 'General case' 0 CA--C 1.508 -0.653 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 1.129 ' O ' ' O ' ' A' ' 44' ' ' ASP . 15.3 pt20 5.64 -164.01 0.0 OUTLIER 'General case' 0 N--CA 1.526 3.364 0 CA-C-O 117.472 -1.251 . . . . 0.0 113.268 -179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.11 28.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 119.553 1.069 . . . . 0.0 109.769 178.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.435 HG23 ' N ' ' A' ' 48' ' ' LYS . 8.2 t -60.28 -42.57 95.72 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.334 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.594 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 82.5 tttt -162.82 135.41 5.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.429 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.2 p-10 -62.22 -10.17 9.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.533 0.683 . . . . 0.0 111.521 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.594 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -73.88 -51.69 15.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.149 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 52' ' ' VAL . 12.0 m -59.26 -56.44 17.04 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.524 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.659 ' N ' HG23 ' A' ' 51' ' ' VAL . 4.3 m -51.81 -33.19 15.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 CA-C-O 121.379 0.609 . . . . 0.0 110.391 -178.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.426 ' HA ' HD12 ' A' ' 56' ' ' ILE . 5.0 tt -74.68 -29.66 61.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.549 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.454 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 11.2 pttm -51.99 -37.89 54.82 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.619 0.724 . . . . 0.0 110.315 -179.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 tpp85 -75.71 -37.2 59.65 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.308 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.426 HD12 ' HA ' ' A' ' 53' ' ' LEU . 67.7 mt -58.66 -50.61 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.14 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 -58.62 -37.05 75.04 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 -179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.454 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 9.0 m-70 -74.55 -39.75 62.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.368 179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.515 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.8 OUTLIER -53.4 -34.74 58.87 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.346 -178.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -50.26 -26.19 4.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.551 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -60.99 -37.85 83.94 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.781 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.97 -49.51 28.77 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.51 -39.46 34.21 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.938 -179.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -64.74 -41.04 96.23 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.444 -178.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HD3' HD13 ' A' ' 11' ' ' ILE . 51.8 mtpt -64.26 -33.11 75.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.307 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 86.8 t -66.04 -42.78 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-O 121.695 0.759 . . . . 0.0 110.344 -179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.549 ' HD2' HD11 ' A' ' 27' ' ' ILE . 18.4 mmmt -66.68 -46.86 74.26 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.295 -0.866 . . . . 0.0 111.163 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 13.2 tpt180 -78.05 -14.66 59.42 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.339 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -91.84 -40.22 5.32 Favored Glycine 0 N--CA 1.47 0.932 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 -179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.525 ' OE2' HD12 ' A' ' 27' ' ' ILE . 1.2 pp20? -71.15 -31.05 67.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.955 0.407 . . . . 0.0 110.422 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.5 p -140.36 112.52 7.74 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.401 0.619 . . . . 0.0 110.762 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.1 -113.74 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.271 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.1 mt -106.32 45.18 0.99 Allowed 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.375 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -89.34 -26.33 21.15 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.572 179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 47.9 m170 53.91 79.19 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.504 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -73.3 -7.44 51.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.555 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.476 ' CG ' ' N ' ' A' ' 78' ' ' HIS . 57.4 t-80 -156.51 166.05 34.52 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.573 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.476 ' N ' ' CG ' ' A' ' 77' ' ' HIS . 78.8 m80 -72.22 151.55 42.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.451 ' ND1' ' O ' ' A' ' 80' ' ' HIS . 58.8 t-80 -162.78 133.52 4.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.53 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.451 ' O ' ' ND1' ' A' ' 79' ' ' HIS . 80.1 m80 . . . . . 0 C--O 1.221 -0.401 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.46 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.493 ' SD ' ' N ' ' B' ' 1' ' ' MET . 2.3 mpt? . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . 0.423 ' O ' ' O ' ' B' ' 1' ' ' MET . 8.2 m 59.38 142.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.716 -179.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -79.02 35.31 0.25 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.956 0.408 . . . . 0.0 110.523 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.404 ' H ' ' C ' ' B' ' 2' ' ' SER . 34.2 mt 49.39 19.08 0.31 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.633 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -69.8 -36.46 75.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.373 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -81.49 135.83 35.62 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.096 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.59 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 1.7 t -71.02 -39.96 9.03 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.892 178.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.59 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 64.6 Cg_exo -52.42 -15.77 4.34 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 121.987 1.792 . . . . 0.0 112.034 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 70.7 t80 -67.57 -51.57 49.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.944 0.402 . . . . 0.0 110.378 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.408 ' CD2' HD21 ' B' ' 59' ' ' LEU . 0.2 OUTLIER -61.91 -40.82 96.79 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.311 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 91.7 mt -63.12 -42.8 97.92 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.509 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -49.13 -23.78 1.39 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.586 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -73.37 -40.31 64.46 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.881 0.372 . . . . 0.0 110.417 179.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.641 ' N ' HD12 ' B' ' 14' ' ' LEU . 7.1 mp -70.15 -39.72 75.19 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.533 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -57.14 -31.58 65.5 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.046 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -65.97 -35.39 80.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.52 179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -62.58 -52.05 64.93 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.879 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 8.0 pt -73.7 -43.87 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 121.408 0.623 . . . . 0.0 110.806 179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -63.91 -23.8 67.49 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.473 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 36.6 mtt -138.6 -146.89 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.109 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p-10 -170.08 39.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.223 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . 0.404 ' O ' ' OG ' ' B' ' 23' ' ' SER . 1.1 tm0? -50.99 -40.2 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.967 0.413 . . . . 0.0 110.756 -179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' B' ' 22' ' ' GLN . 5.0 m -177.46 64.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.185 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -164.66 -135.41 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.312 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -157.23 -161.31 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.26 0.552 . . . . 0.0 110.318 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.422 ' NZ ' HD11 ' B' ' 27' ' ' ILE . 62.0 tttm -86.49 -103.59 0.07 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.352 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.517 ' C ' ' H ' ' B' ' 29' ' ' ALA . 44.8 mm -64.6 -40.99 90.97 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 N-CA-C 110.267 -0.271 . . . . 0.0 110.267 179.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -61.16 3.39 0.1 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.789 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.517 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -74.08 -44.87 52.45 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.55 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.576 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.83 -47.23 84.29 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.25 179.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.604 HD21 ' ND2' ' A' ' 31' ' ' ASN . 2.0 t30 -54.97 -53.36 56.66 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.25 -0.58 . . . . 0.0 110.714 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.7 t -62.49 -53.29 57.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 120.241 -0.584 . . . . 0.0 110.833 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.61 ' CE2' HD11 ' B' ' 14' ' ' LEU . 77.7 t80 -60.38 -49.08 78.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.903 0.383 . . . . 0.0 110.495 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.437 ' CB ' ' O ' ' B' ' 30' ' ' MET . 35.3 t80 -57.86 -54.56 45.48 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.794 -179.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.676 ' HE ' ' ND2' ' A' ' 31' ' ' ASN . 6.9 tmm_? -61.63 -32.73 72.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 121.155 0.503 . . . . 0.0 110.429 -179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.3 t -68.75 -44.14 74.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.771 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 38.5 t -66.59 -63.95 0.82 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.646 -179.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.578 HG23 ' N ' ' B' ' 39' ' ' SER . 20.2 m -48.5 -45.87 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.518 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.578 ' N ' HG23 ' B' ' 38' ' ' VAL . 46.1 t -60.15 -41.08 91.98 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.281 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 94.8 m -69.0 -49.21 59.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.968 0.413 . . . . 0.0 110.708 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.66 -40.4 95.36 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.514 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.672 ' O ' HG12 ' B' ' 42' ' ' VAL . 60.7 t -85.1 19.76 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.076 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 36.6 tp60 -162.12 21.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -161.98 14.14 0.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.363 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -172.6 55.63 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.545 -179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 35.1 mt -87.67 48.63 1.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.409 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -72.28 -27.17 62.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.31 0.576 . . . . 0.0 110.586 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 tptt -172.32 133.74 0.67 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.868 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' B' ' 53' ' ' LEU . 10.0 m120 -52.38 -42.87 64.35 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.465 179.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.59 86.99 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.44 -0.504 . . . . 0.0 110.939 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 14.1 t -51.97 -44.23 38.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.434 -179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -78.46 -39.75 23.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.185 0.516 . . . . 0.0 110.642 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' B' ' 49' ' ' ASN . 0.2 OUTLIER -55.44 -58.62 7.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.912 -178.4 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -55.71 -37.96 69.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.365 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 62.8 mmt-85 -64.2 -41.34 97.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.481 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.425 ' O ' ' N ' ' B' ' 59' ' ' LEU . 94.3 mt -65.74 -49.0 80.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 C-N-CA 120.88 -0.328 . . . . 0.0 110.264 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -49.41 -30.85 8.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.237 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -71.42 -29.24 64.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' B' ' 56' ' ' ILE . 0.4 OUTLIER -77.46 -26.32 51.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.125 179.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -61.94 -54.6 39.54 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 120.33 -0.548 . . . . 0.0 110.455 -179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -62.35 -26.45 68.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.703 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.36 -52.09 17.62 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 120.826 0.346 . . . . 0.0 110.851 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.433 ' CD1' ' C ' ' B' ' 63' ' ' TYR . 0.0 OUTLIER -53.35 -44.68 68.7 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.311 0.577 . . . . 0.0 110.017 -179.661 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -66.58 -31.17 71.7 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.159 -178.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 16.4 tptp -63.61 -31.27 72.39 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.531 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 96.2 t -63.75 -55.44 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.3 0.572 . . . . 0.0 110.656 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -69.8 -46.37 65.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 122.347 1.07 . . . . 0.0 111.881 -179.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 11.7 mmm180 -44.27 -35.93 2.52 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.068 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -77.49 -55.76 4.15 Favored Glycine 0 N--CA 1.443 -0.883 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -47.05 -84.99 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.642 0.258 . . . . 0.0 110.844 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 25.2 t 51.27 -151.29 0.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.081 0.467 . . . . 0.0 110.442 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 17.9 mmmt -56.63 -69.74 0.14 Allowed 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.648 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.428 HD23 ' H ' ' B' ' 75' ' ' HIS . 0.6 OUTLIER -174.37 129.1 0.35 Allowed 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 120.961 0.41 . . . . 0.0 110.3 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -143.56 24.09 1.75 Allowed 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.464 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.428 ' H ' HD23 ' B' ' 73' ' ' LEU . 81.8 t60 -89.79 115.87 27.46 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.039 0.447 . . . . 0.0 110.375 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -72.78 131.81 42.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.503 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -76.35 148.31 37.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.354 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -137.21 121.54 18.14 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.609 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 85.3 t60 -64.31 -47.01 81.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.428 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 p80 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.522 -179.908 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.523 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.5 t 55.33 172.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.48 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -68.99 178.78 2.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.315 0.579 . . . . 0.0 110.069 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' A' ' 5' ' ' PHE . 5.4 mp -74.3 -93.89 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.678 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.492 ' O ' ' CB ' ' A' ' 6' ' ' SER . 87.2 t80 36.78 74.33 0.08 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.497 0.665 . . . . 0.0 110.9 -179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.492 ' CB ' ' O ' ' A' ' 5' ' ' PHE . 3.2 t 151.24 72.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.063 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.474 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.1 OUTLIER -34.22 -53.03 0.93 Allowed Pre-proline 0 N--CA 1.482 1.171 0 CA-C-N 118.225 0.466 . . . . 0.0 111.146 178.276 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 11.3 Cg_endo -51.29 -21.17 9.31 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 120.407 0.738 . . . . 0.0 112.671 178.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.485 ' N ' ' O ' ' A' ' 6' ' ' SER . 7.3 t80 -62.2 -42.96 99.78 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.341 0.591 . . . . 0.0 110.642 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -84.1 -52.49 6.24 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.879 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 96.2 mt -53.66 -35.85 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.601 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -49.3 -31.07 8.37 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 120.599 -0.44 . . . . 0.0 110.22 -179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.476 ' OD1' ' NE2' ' A' ' 17' ' ' HIS . 53.4 t-20 -72.37 -45.34 60.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.849 0.356 . . . . 0.0 110.211 179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 ' CD1' ' A' ' 33' ' ' TYR . 56.5 mt -61.45 -42.5 98.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.613 -179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -57.31 -38.84 74.65 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 56.9 tt0 -69.04 -33.92 74.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.685 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.476 ' NE2' ' OD1' ' A' ' 13' ' ' ASN . 8.8 m-70 -63.62 -51.74 63.92 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.272 -0.571 . . . . 0.0 110.715 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.5 pt -70.17 -42.54 79.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-O 121.119 0.485 . . . . 0.0 110.938 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -57.63 -52.2 66.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.206 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 63.6 mtm -114.29 -125.53 0.28 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.432 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -170.07 61.62 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.396 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.19 51.74 0.32 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.968 0.889 . . . . 0.0 110.91 -179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.41 ' O ' ' OG ' ' A' ' 23' ' ' SER . 3.4 p 77.42 46.26 0.07 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.257 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -147.18 -142.88 0.13 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.627 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -153.54 -168.28 2.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.234 0.54 . . . . 0.0 110.657 -179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.33 -100.78 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.176 179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.647 ' C ' ' H ' ' A' ' 29' ' ' ALA . 11.0 tp -63.53 -42.45 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 -179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.467 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.5 m-70 -63.82 19.42 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.873 0.368 . . . . 0.0 110.99 179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.647 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -79.73 -46.7 16.57 Favored 'General case' 0 CA--C 1.514 -0.404 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.268 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.557 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.98 -50.64 65.55 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.252 -179.2 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.478 ' N ' ' SD ' ' A' ' 30' ' ' MET . 82.5 m-20 -51.41 -38.55 54.09 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.453 -178.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 t -77.2 -54.26 6.72 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.615 179.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.552 ' CD1' HD21 ' A' ' 14' ' ' LEU . 58.4 t80 -63.95 -47.69 79.45 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.18 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.551 ' N ' ' O ' ' A' ' 30' ' ' MET . 57.7 t80 -55.56 -51.77 65.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.751 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 58.6 ttt85 -63.35 -34.73 78.35 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 52.7 p -63.93 -42.52 97.33 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.364 -179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.5 t -69.98 -56.83 9.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.376 -0.529 . . . . 0.0 110.171 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.7 t -50.01 -45.35 22.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.417 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 15.1 m -68.69 -18.74 64.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.668 0.27 . . . . 0.0 110.416 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.512 ' O ' ' N ' ' A' ' 44' ' ' ASP . 92.4 m -88.63 -54.31 4.22 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.066 0.46 . . . . 0.0 110.961 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 98.5 mt -61.5 -39.5 91.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.445 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 p -69.31 -25.53 29.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.4 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -98.75 -22.13 16.03 Favored 'General case' 0 N--CA 1.479 1.002 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.191 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.512 ' N ' ' O ' ' A' ' 40' ' ' THR . 14.3 m-20 -91.04 -34.77 14.98 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 120.948 0.404 . . . . 0.0 110.518 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.441 HE22 ' CZ ' ' A' ' 55' ' ' ARG . 9.5 tt0 -106.98 161.6 14.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.374 0.607 . . . . 0.0 110.211 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -168.27 22.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.367 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 49.9 m -61.5 -42.99 99.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.467 0.651 . . . . 0.0 110.597 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 8.3 ttmt -173.86 141.51 0.81 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.703 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -48.78 -38.39 21.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.38 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.498 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -69.03 -50.16 51.1 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.351 -0.539 . . . . 0.0 110.765 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 37.5 t -52.41 -43.57 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.499 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.4 m -78.69 -37.92 21.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.242 178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.9 tp -62.28 -46.29 89.42 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.098 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 51' ' ' VAL . 17.9 ptmt -54.85 -40.93 70.15 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.03 -179.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.441 ' CZ ' HE22 ' A' ' 45' ' ' GLN . 93.1 mtt180 -63.95 -39.54 94.38 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.824 -179.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 98.9 mt -69.06 -48.66 68.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -58.6 -34.4 71.08 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.411 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 51.0 m170 -76.56 -43.14 40.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.871 0.367 . . . . 0.0 110.358 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 42.4 tp -48.76 -22.63 0.84 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.447 -179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 10.8 p-10 -58.6 -26.66 63.9 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.021 0.438 . . . . 0.0 110.416 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.441 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 10.4 pt-20 -60.85 -38.63 86.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.407 -179.308 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.28 -55.06 10.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.401 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.665 ' CE2' ' NH2' ' B' ' 35' ' ' ARG . 0.0 OUTLIER -51.23 -46.07 62.17 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 121.264 0.554 . . . . 0.0 110.211 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -61.66 -33.09 73.35 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.128 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.6 tptm -62.8 -39.61 94.8 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.647 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.85 -48.72 87.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.339 0.59 . . . . 0.0 110.132 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -42.71 93.54 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 122.016 0.912 . . . . 0.0 111.523 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 75.1 mtp180 -60.87 -34.85 75.26 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.942 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.2 -25.57 28.41 Favored Glycine 0 CA--C 1.52 0.371 0 N-CA-C 110.864 -0.895 . . . . 0.0 110.864 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -104.89 -160.71 0.77 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.131 0.491 . . . . 0.0 110.253 -179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 37.9 t 53.54 74.66 0.3 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.438 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -73.29 -28.63 62.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.482 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.62 ' O ' ' N ' ' A' ' 75' ' ' HIS . 7.7 tp -44.63 -63.66 0.86 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.433 0.635 . . . . 0.0 110.857 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 55.92 -71.1 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.801 0.81 . . . . 0.0 110.834 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.62 ' N ' ' O ' ' A' ' 73' ' ' LEU . 30.2 p-80 -167.1 160.76 14.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.708 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -64.52 138.41 58.4 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.406 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 74.4 m80 -61.68 138.48 58.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.434 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -73.1 153.87 40.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.457 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 71.4 m80 -144.6 146.94 32.57 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.58 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.495 ' N ' ' ND1' ' A' ' 80' ' ' HIS . 0.0 OUTLIER . . . . . 0 C--O 1.221 -0.398 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.564 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 79.2 p -74.57 157.4 35.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.583 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -65.32 157.19 29.78 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.278 0.561 . . . . 0.0 110.54 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 40.8 mt -64.2 -41.5 97.05 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.736 -179.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.467 ' O ' ' CB ' ' B' ' 6' ' ' SER . 83.3 t80 -48.57 105.49 0.08 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.837 0.827 . . . . 0.0 110.252 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' B' ' 5' ' ' PHE . 1.0 OUTLIER 161.25 97.08 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.472 179.601 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.496 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 18.7 t -46.22 -43.27 32.7 Favored Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 120.658 -0.417 . . . . 0.0 110.369 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.496 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 23.8 Cg_exo -66.16 -20.75 56.19 Favored 'Trans proline' 0 C--N 1.305 -1.753 0 C-N-CA 120.401 0.734 . . . . 0.0 111.805 179.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -80.52 -57.43 3.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.341 0.591 . . . . 0.0 110.942 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -43.91 -47.45 8.4 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.622 -178.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 70.4 mt -66.46 -48.19 81.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-O 121.38 0.61 . . . . 0.0 111.234 178.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.24 -27.82 0.7 Allowed 'General case' 0 N--CA 1.483 1.206 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.716 -178.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' B' ' 17' ' ' HIS . 18.9 m120 -75.13 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.307 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 34.8 mt -61.63 -43.25 99.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.225 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -59.06 -44.03 91.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.437 ' O ' ' CB ' ' B' ' 20' ' ' MET . 56.5 tt0 -67.57 -29.5 68.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.89 0.376 . . . . 0.0 110.245 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' B' ' 13' ' ' ASN . 47.8 m170 -67.95 -53.69 24.31 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.769 -179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.3 pt -72.97 -43.48 58.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.132 0.492 . . . . 0.0 110.707 179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -69.56 -48.36 60.56 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.353 -179.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.437 ' CB ' ' O ' ' B' ' 16' ' ' GLN . 3.9 tpp -99.94 -163.7 1.05 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 121.357 0.599 . . . . 0.0 110.19 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -155.78 41.55 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.436 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 -58.88 -49.2 78.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.011 0.434 . . . . 0.0 110.469 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -175.45 69.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -163.8 -148.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.083 0.468 . . . . 0.0 110.201 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -142.76 -164.46 1.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.363 0.601 . . . . 0.0 110.43 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -88.81 -104.82 0.08 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.441 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.536 HD13 ' OE1' ' B' ' 70' ' ' GLU . 7.0 tp -61.05 -40.67 86.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . 0.452 ' N ' HG23 ' B' ' 27' ' ' ILE . 77.5 m80 -60.02 -14.5 16.59 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.261 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.97 -45.08 51.21 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.744 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.525 ' CG ' ' N ' ' B' ' 31' ' ' ASN . 14.0 ptt? -63.4 -52.14 62.85 Favored 'General case' 0 N--CA 1.445 -0.685 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.316 179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.525 ' N ' ' CG ' ' B' ' 30' ' ' MET . 97.8 m-20 -62.41 -45.0 95.1 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.775 -178.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.6 t -63.11 -45.33 92.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.57 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 81.6 t80 -75.25 -46.75 31.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.804 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.434 ' N ' ' O ' ' B' ' 30' ' ' MET . 57.2 t80 -49.02 -51.3 31.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.766 -179.172 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.665 ' NH2' ' CE2' ' A' ' 63' ' ' TYR . 67.5 ttt-85 -66.41 -28.94 69.01 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 179.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 5.6 t -62.27 -44.23 97.01 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' B' ' 41' ' ' LEU . 66.4 t -70.79 -58.92 4.11 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 C-N-CA 120.359 -0.536 . . . . 0.0 109.862 179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 46.6 t -49.43 -49.26 18.51 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.763 -179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 59.7 p -49.04 -61.26 2.16 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 120.15 -0.62 . . . . 0.0 111.383 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 23.8 m -73.0 -44.66 60.78 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 122.443 1.116 . . . . 0.0 111.534 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' B' ' 37' ' ' VAL . 53.6 tp -53.53 -28.51 31.77 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.512 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.686 ' O ' HG12 ' B' ' 42' ' ' VAL . 96.1 t -96.48 21.9 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.16 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -138.05 -2.29 1.89 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.457 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -101.83 -38.62 7.76 Favored 'General case' 0 N--CA 1.472 0.652 0 CA-C-O 120.988 0.423 . . . . 0.0 110.358 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 9.3 tp60 -110.29 174.13 6.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.522 0.677 . . . . 0.0 110.018 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -178.61 26.3 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.208 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 4.9 t -71.7 -34.18 69.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.357 0.598 . . . . 0.0 110.725 -179.569 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 18.0 tptm -169.35 129.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.621 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -49.43 -32.38 11.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.232 179.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -70.52 -50.77 34.2 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.318 0.58 . . . . 0.0 110.702 179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 15.9 t -49.49 -43.67 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.447 -179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -75.98 -36.63 32.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 C-N-CA 120.159 -0.616 . . . . 0.0 111.028 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.51 -35.61 81.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.648 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 65.2 mttm -54.6 -44.63 73.23 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.204 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 11.6 mpt_? -69.77 -40.78 75.85 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 80.1 mt -63.67 -54.65 29.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.801 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -58.15 -34.13 69.94 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.508 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 5.1 m-70 -76.61 -42.47 42.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.478 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 57.1 tp -47.07 -22.15 0.32 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.583 -179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' B' ' 61' ' ' GLU . 21.7 p-10 -58.94 -28.23 66.06 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.372 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.469 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 12.5 pt-20 -56.86 -40.48 76.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.343 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -51.44 32.97 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.571 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.43 -39.21 15.04 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-O 121.035 0.445 . . . . 0.0 109.926 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -65.42 -34.17 77.67 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.561 -179.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 36.8 tptt -57.32 -42.95 82.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.455 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.41 -47.3 92.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 122.286 1.041 . . . . 0.0 110.718 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -44.37 92.48 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.893 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 66.9 ttp85 -67.02 -16.04 64.1 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 114.892 -1.049 . . . . 0.0 110.065 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -92.52 -63.98 1.12 Allowed Glycine 0 N--CA 1.463 0.441 0 N-CA-C 110.575 -1.01 . . . . 0.0 110.575 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.638 ' CG ' ' H ' ' B' ' 71' ' ' SER . 0.0 OUTLIER -50.44 -94.49 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 120.734 0.302 . . . . 0.0 110.626 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.638 ' H ' ' CG ' ' B' ' 70' ' ' GLU . 96.0 p 47.61 -160.75 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.1 0.476 . . . . 0.0 110.515 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -94.08 -37.08 11.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.567 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 15.9 mt -77.94 130.2 36.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.481 0.657 . . . . 0.0 110.126 -179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -137.17 66.13 1.47 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.338 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' B' ' 77' ' ' HIS . 53.4 t60 -76.64 128.91 35.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.246 179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.476 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 98.3 m-70 -157.49 -56.02 0.08 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.492 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.5 ' CE1' ' CE1' ' B' ' 75' ' ' HIS . 1.5 m80 58.6 140.61 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.609 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -72.6 154.04 40.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.859 0.362 . . . . 0.0 110.375 -179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -63.63 138.84 58.66 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.422 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 80.2 m80 . . . . . 0 C--O 1.219 -0.506 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.706 -179.986 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 tpt . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -167.48 71.78 0.11 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 0.0 110.62 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -90.0 82.54 6.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.336 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.6 mt -66.28 -24.04 66.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.335 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -59.07 -45.33 91.08 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.247 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.3 p -76.36 126.67 31.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.514 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.5 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 78.1 t -59.47 -44.84 98.58 Favored Pre-proline 0 N--CA 1.452 -0.352 0 CA-C-O 119.036 -0.506 . . . . 0.0 109.858 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 73.1 Cg_exo -44.7 -31.72 5.25 Favored 'Trans proline' 0 C--N 1.306 -1.67 0 C-N-CA 121.241 1.294 . . . . 0.0 112.317 -179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.55 -43.05 89.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.923 0.392 . . . . 0.0 110.237 -179.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.427 ' CE2' ' OH ' ' A' ' 33' ' ' TYR . 0.2 OUTLIER -66.1 -45.54 80.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.458 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.34 -50.44 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.92 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -47.29 -39.94 15.73 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.676 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 35.4 m-20 -51.84 -30.49 23.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.032 0.444 . . . . 0.0 110.315 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 mt -73.58 -41.22 63.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.568 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -54.78 -34.13 62.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 120.92 0.391 . . . . 0.0 110.177 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 57.3 tt0 -64.34 -27.44 69.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.333 179.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.422 ' O ' ' CA ' ' A' ' 21' ' ' ASN . 2.0 m-70 -71.71 -52.86 15.64 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.6 pt -73.98 -38.19 49.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.446 0.641 . . . . 0.0 110.944 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.2 tp10 -62.58 -44.67 95.73 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.691 -179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.443 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 28.8 ttp -114.96 -65.06 1.23 Allowed 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.294 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.443 ' CB ' ' O ' ' A' ' 20' ' ' MET . 5.6 t30 81.48 45.21 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -55.18 -37.41 67.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.166 0.507 . . . . 0.0 110.556 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.1 m -158.12 63.07 0.45 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.643 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -159.66 -130.93 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 120.981 0.419 . . . . 0.0 110.491 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.43 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 65.3 m-20 -159.39 167.66 28.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.197 0.523 . . . . 0.0 110.429 -179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 87.5 tttt -69.9 -99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.454 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.565 ' C ' ' H ' ' A' ' 29' ' ' ALA . 10.7 tp -61.14 -43.15 95.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.015 0.436 . . . . 0.0 110.637 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.503 ' N ' HG23 ' A' ' 27' ' ' ILE . 94.8 m-70 -67.72 17.91 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.642 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.565 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -58.97 -51.93 67.96 Favored 'General case' 0 CA--C 1.515 -0.394 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' HG21 ' A' ' 66' ' ' VAL . 66.9 mmm -61.68 -44.55 96.74 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.106 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -46.55 -33.69 4.3 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.562 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.4 m -89.15 -57.11 3.01 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.913 0.387 . . . . 0.0 110.736 178.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.427 ' OH ' ' CE2' ' A' ' 10' ' ' PHE . 38.6 t80 -61.37 -53.06 61.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.7 -179.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.527 ' N ' ' O ' ' A' ' 30' ' ' MET . 28.0 t80 -49.01 -49.55 40.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.234 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -66.5 -28.56 68.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.301 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 5.5 t -63.4 -46.18 87.62 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.67 -0.241 . . . . 0.0 110.359 179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.458 ' O ' ' N ' ' A' ' 41' ' ' LEU . 35.3 t -71.0 -56.34 10.95 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.617 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.116 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.5 t -51.36 -47.67 34.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 C-N-CA 120.659 -0.416 . . . . 0.0 110.454 -179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 p -53.82 -60.28 3.52 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.085 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 22.1 m -69.49 -44.58 70.81 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.919 0.866 . . . . 0.0 111.045 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.458 ' N ' ' O ' ' A' ' 37' ' ' VAL . 41.8 tp -56.26 -27.77 56.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.598 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 98.6 t -101.87 -33.64 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.205 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -80.16 -0.29 35.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.339 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 45' ' ' GLN . 43.5 t0 -145.46 165.16 29.36 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.37 0.605 . . . . 0.0 110.252 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 44' ' ' ASP . 49.3 tt0 72.42 -78.28 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.606 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 17.1 mt 42.09 41.15 1.9 Allowed 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.403 ' H ' ' HG2' ' A' ' 45' ' ' GLN . 11.4 t -73.4 -34.61 65.6 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.397 0.618 . . . . 0.0 110.79 -179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -167.49 133.68 2.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.784 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LEU . 8.9 m120 -49.72 -47.07 50.82 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.664 179.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.61 83.58 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 120.31 -0.556 . . . . 0.0 110.774 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 18.0 t -52.96 -43.84 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.547 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.451 ' O ' HG12 ' A' ' 56' ' ' ILE . 28.8 m -81.1 -46.33 20.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.161 0.505 . . . . 0.0 110.556 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.675 HD12 HE21 ' A' ' 57' ' ' GLN . 0.2 OUTLIER -57.15 -55.94 28.17 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.808 -178.598 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 17.4 ptmt -50.99 -40.02 57.04 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.236 0.541 . . . . 0.0 110.411 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.439 ' N ' ' CG ' ' A' ' 54' ' ' LYS . 40.0 ttm180 -65.08 -39.18 92.84 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.147 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 52' ' ' VAL . 34.3 mm -61.36 -52.95 55.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.247 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.675 HE21 HD12 ' A' ' 53' ' ' LEU . 75.8 mt-30 -52.52 -40.97 63.03 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.465 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 2.8 t-80 -66.97 -46.16 75.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.11 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 29.3 tp -53.0 -23.65 7.8 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.917 0.389 . . . . 0.0 110.598 -179.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -55.64 -49.26 73.34 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.434 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.465 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 6.2 pt-20 -50.74 -28.59 9.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.684 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 59' ' ' LEU . . . -68.56 -62.22 1.49 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.34 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.43 ' CE2' ' OD1' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -52.47 -38.89 60.42 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.038 0.447 . . . . 0.0 110.25 179.866 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 68' ' ' ARG . 61.4 m-80 -65.32 -27.64 68.74 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.165 -179.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.9 tptm -75.88 -39.74 55.87 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.475 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.576 HG21 ' SD ' ' A' ' 30' ' ' MET . 99.1 t -63.03 -52.05 64.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.369 0.604 . . . . 0.0 110.587 -179.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -63.26 -44.96 93.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.801 0.81 . . . . 0.0 111.072 -179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.435 ' CG ' ' O ' ' A' ' 64' ' ' ASN . 12.1 mmm180 -55.34 -31.38 61.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.981 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.96 -22.31 61.53 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.935 -0.866 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -85.94 -168.04 2.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.922 0.391 . . . . 0.0 110.546 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.471 ' O ' ' C ' ' A' ' 72' ' ' LYS . 68.3 m -91.21 54.3 2.55 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.176 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.471 ' C ' ' O ' ' A' ' 71' ' ' SER . 47.7 mtpt 29.42 -125.23 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.1 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 75' ' ' HIS . 24.6 mt -95.54 17.24 15.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.159 179.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 52.62 11.52 0.19 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.087 0.47 . . . . 0.0 110.557 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.428 ' H ' ' C ' ' A' ' 73' ' ' LEU . 98.5 m-70 52.0 177.96 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.557 -179.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 11.4 p80 -155.82 9.66 0.27 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.492 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 84.4 t60 51.11 98.0 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.547 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 52.3 p-80 -63.92 179.67 0.5 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.568 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.423 ' O ' ' CG ' ' A' ' 79' ' ' HIS . 6.3 p80 -161.44 84.87 0.64 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.415 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.0 t60 . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.734 179.826 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -66.54 134.98 53.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.439 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -84.18 137.99 33.22 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.272 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -173.86 -35.31 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.527 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -60.66 -44.38 96.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.237 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.5 p -66.51 125.87 27.09 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.405 -179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.549 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.9 OUTLIER -57.32 -42.61 96.9 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.967 179.107 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.9 Cg_exo -50.16 -31.16 27.74 Favored 'Trans proline' 0 C--N 1.305 -1.713 0 C-N-CA 121.737 1.624 . . . . 0.0 112.097 -179.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -59.98 -43.87 94.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.875 0.369 . . . . 0.0 110.339 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.455 ' CE2' ' OH ' ' B' ' 33' ' ' TYR . 0.1 OUTLIER -63.79 -46.43 85.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.215 -179.473 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 38.3 mt -61.11 -47.04 95.38 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-O 121.052 0.453 . . . . 0.0 110.587 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -48.43 -35.0 11.91 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.551 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -58.39 -34.31 70.59 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.672 ' N ' HD12 ' B' ' 14' ' ' LEU . 6.6 mp -72.44 -37.23 68.62 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.246 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -61.82 -38.32 87.7 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.329 -179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -54.26 -24.93 20.7 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.556 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.425 ' O ' ' CA ' ' B' ' 21' ' ' ASN . 28.3 m170 -76.38 -54.62 6.49 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.956 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 2.4 pt -70.84 -38.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-O 121.483 0.659 . . . . 0.0 110.625 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -63.72 -43.0 97.83 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.004 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.444 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 48.9 mtt -115.56 -65.16 1.22 Allowed 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.066 -179.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.444 ' CB ' ' O ' ' B' ' 20' ' ' MET . 24.3 t30 82.9 46.78 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 109.831 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -58.7 -40.98 85.22 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.411 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 19.6 m -158.57 69.81 0.5 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.576 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -165.17 -125.32 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.076 0.465 . . . . 0.0 110.338 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -158.17 -175.92 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.33 0.586 . . . . 0.0 110.048 -179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -86.4 -98.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.533 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.444 ' C ' ' H ' ' B' ' 29' ' ' ALA . 4.3 mm -61.71 -43.16 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 C-N-CA 120.315 -0.554 . . . . 0.0 110.436 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 98.8 m-70 -62.14 -0.58 0.55 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.74 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.444 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -57.29 -49.86 74.73 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.114 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.572 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -68.67 -40.51 80.09 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.283 179.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.572 ' N ' ' SD ' ' B' ' 30' ' ' MET . 40.7 t30 -55.54 -50.62 69.54 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.668 -179.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 9.2 t -67.01 -51.45 54.75 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.559 -0.457 . . . . 0.0 110.696 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.604 ' CE1' HD11 ' B' ' 14' ' ' LEU . 54.1 t80 -61.43 -50.0 74.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.478 -179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.448 ' CB ' ' O ' ' B' ' 30' ' ' MET . 39.4 t80 -55.98 -48.48 75.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.104 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.0 ttp85 -64.87 -34.36 78.19 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 120.857 0.361 . . . . 0.0 110.27 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.2 p -67.75 -39.07 84.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.646 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.4 HG21 ' CE1' ' B' ' 33' ' ' TYR . 43.0 t -68.97 -63.45 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.401 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.522 HG23 ' N ' ' B' ' 39' ' ' SER . 23.7 m -50.55 -42.31 21.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.369 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.522 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.2 p -62.05 -46.23 90.07 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.419 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 97.1 m -63.65 -44.28 94.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.399 -179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.504 ' O ' ' O ' ' B' ' 44' ' ' ASP . 90.4 mt -70.37 -50.67 36.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.705 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 62.8 t -60.91 -19.19 19.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.082 179.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -103.62 6.69 37.3 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-O 120.855 0.36 . . . . 0.0 110.854 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.504 ' O ' ' O ' ' B' ' 41' ' ' LEU . 39.7 t0 -148.35 170.12 18.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.606 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.459 HE22 HH12 ' B' ' 55' ' ' ARG . 5.4 pt20 39.88 48.28 2.01 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.352 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 mt -75.37 46.19 0.33 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.353 -179.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.403 HG23 ' N ' ' B' ' 48' ' ' LYS . 3.6 t -61.04 -41.16 96.05 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.204 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.403 ' N ' HG23 ' B' ' 47' ' ' THR . 39.7 tptt -167.32 134.43 2.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.754 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -50.24 -37.51 36.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.539 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.98 -51.27 68.76 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.49 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 36.7 t -50.61 -38.65 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 116.346 -0.388 . . . . 0.0 109.988 179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 5.2 t -80.76 -43.06 20.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.597 0.713 . . . . 0.0 111.008 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 35.2 tp -54.93 -52.75 62.0 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.141 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.48 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 49.9 pttt -51.34 -42.39 61.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.187 -179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.48 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 78.3 mtp180 -65.71 -45.35 83.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.336 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.0 mt -62.78 -54.83 28.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 C-N-CA 120.739 -0.385 . . . . 0.0 110.362 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -53.2 -40.21 64.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.313 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 57.0 m170 -75.21 -38.27 60.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.275 179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 52.8 tp -51.75 -32.28 30.03 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.63 -179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -50.95 -29.03 11.09 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.482 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -56.69 -35.57 68.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.6 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.63 -60.83 2.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.486 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.27 -43.43 22.22 Favored 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 120.961 0.41 . . . . 0.0 110.158 -179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -62.05 -39.66 93.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.293 -179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.3 tptm -66.74 -36.63 82.91 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.441 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 71.0 t -60.4 -51.07 77.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.232 0.539 . . . . 0.0 110.355 -179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 3.3 mtmt -66.33 -48.39 70.43 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.267 -179.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 57.2 ttp180 -61.08 -21.64 63.87 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.219 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -81.6 -27.11 48.52 Favored Glycine 0 CA--C 1.522 0.484 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.482 ' O ' ' N ' ' B' ' 72' ' ' LYS . 36.8 mm-40 -70.66 -115.7 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 2.8 t 66.26 -64.43 0.22 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.677 -179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.482 ' N ' ' O ' ' B' ' 70' ' ' GLU . 99.7 mttt 53.02 33.97 16.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.374 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.452 HD13 ' O ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -62.25 -56.9 13.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.399 0.619 . . . . 0.0 110.97 -179.13 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -51.13 -96.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.515 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -159.11 152.21 22.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.198 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.623 ' CG ' ' H ' ' B' ' 77' ' ' HIS . 78.9 t60 -157.24 178.67 10.07 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.192 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.623 ' H ' ' CG ' ' B' ' 76' ' ' HIS . 33.4 p-80 -148.63 165.71 30.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.461 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -137.15 136.73 38.5 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.436 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 77.1 m80 47.13 63.19 2.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.702 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.0 t60 . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 118.05 -0.976 . . . . 0.0 110.379 -179.81 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.701 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.7 m -72.32 144.32 48.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.37 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -74.35 125.58 28.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.15 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 50.7 mt 45.26 -152.37 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.516 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 32.8 t80 68.22 -50.02 0.55 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.117 0.484 . . . . 0.0 110.573 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -52.16 102.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.208 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.492 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 3.0 t -47.56 -42.64 44.77 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 118.854 -0.593 . . . . 0.0 110.245 179.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.492 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 37.8 Cg_exo -58.62 -22.89 62.71 Favored 'Trans proline' 0 C--N 1.306 -1.701 0 C-N-CA 120.754 0.97 . . . . 0.0 111.86 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -63.77 -48.35 77.3 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.912 0.387 . . . . 0.0 110.547 -179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.459 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 2.4 m-85 -48.83 -45.3 40.4 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.297 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 14' ' ' LEU . 45.9 mt -70.21 -50.4 47.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.695 0.76 . . . . 0.0 110.833 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -48.41 -24.13 1.15 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.412 -178.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -72.3 -36.47 68.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.046 0.45 . . . . 0.0 110.179 179.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.401 ' N ' ' O ' ' A' ' 11' ' ' ILE . 17.0 mt -70.52 -48.12 57.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.387 -179.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 12.9 ttmm -59.02 -27.8 65.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.287 -179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.1 tt0 -62.53 -27.52 69.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.18 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.472 ' CE1' ' C ' ' A' ' 24' ' ' GLU . 48.5 t60 -81.86 -60.69 2.15 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.488 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.417 ' H ' HG23 ' A' ' 18' ' ' ILE . 2.4 pt -50.9 -39.06 18.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 CA-C-O 121.836 0.827 . . . . 0.0 110.259 -179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 39.2 tp10 -72.21 -32.15 66.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.458 -179.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -136.54 -121.77 0.15 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.4 t30 -174.61 72.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 110.357 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -77.21 -54.98 5.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.13 0.49 . . . . 0.0 110.198 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.9 m 170.61 78.27 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.367 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' C ' ' CE1' ' A' ' 17' ' ' HIS . 21.3 tp10 -170.68 -131.54 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.288 0.565 . . . . 0.0 110.219 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.424 ' O ' ' CD2' ' A' ' 17' ' ' HIS . 71.5 m-20 -152.23 176.53 11.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.3 179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -72.89 -102.47 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.506 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.406 ' C ' ' H ' ' A' ' 29' ' ' ALA . 2.9 mm -64.29 -41.49 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 78.0 m80 -55.43 -9.23 0.44 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.204 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.406 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -51.88 -42.64 62.83 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.513 ' CG ' ' N ' ' A' ' 31' ' ' ASN . 11.6 ptt? -66.05 -54.62 23.56 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.513 ' N ' ' CG ' ' A' ' 30' ' ' MET . 61.6 t-20 -57.3 -55.01 40.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.649 -178.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -56.39 -51.43 68.34 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.322 -0.551 . . . . 0.0 110.642 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 58.5 t80 -63.02 -47.16 84.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.872 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.599 ' O ' HG23 ' A' ' 38' ' ' VAL . 22.1 t80 -53.4 -43.88 68.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.864 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -74.73 -28.32 60.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.827 179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.7 p -64.51 -44.91 89.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.43 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 66.1 t -72.01 -54.18 17.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.529 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' ' 34' ' ' TYR . 94.3 t -48.53 -47.01 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.337 -179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.7 t -56.65 -46.94 80.77 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.277 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 41.4 m -64.57 -45.4 87.2 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.41 0.624 . . . . 0.0 111.272 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.06 -37.83 88.83 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.726 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 42' ' ' VAL . 48.5 t -92.9 25.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.695 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -147.49 -0.89 0.64 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.45 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 46' ' ' LEU . 73.4 m-20 -145.41 170.83 15.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.309 0.576 . . . . 0.0 110.288 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 62.35 -71.56 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.428 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' ASP . 15.8 mt 44.53 70.45 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.277 0.561 . . . . 0.0 110.604 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.5 t -109.53 -31.12 7.62 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.439 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.1 tptt -171.6 129.05 0.67 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.65 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -49.15 -38.8 26.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.513 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.8 76.92 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.847 179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 24.6 t -54.48 -55.14 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 120.263 -0.575 . . . . 0.0 110.418 -179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.415 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.7 m -64.64 -40.71 90.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.357 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.257 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.415 ' N ' HG23 ' A' ' 52' ' ' VAL . 66.0 tp -60.96 -43.1 99.22 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.359 -179.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' CG ' ' A' ' 58' ' ' HIS . 51.1 mtpt -56.66 -41.19 76.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.08 -179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -64.41 -39.9 94.75 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 89.9 mt -69.09 -51.92 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.614 0.245 . . . . 0.0 110.744 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -55.42 -38.44 68.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.143 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CG ' ' O ' ' A' ' 54' ' ' LYS . 5.5 m-70 -73.36 -22.62 60.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.927 0.394 . . . . 0.0 110.403 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 59' ' ' LEU . 0.7 OUTLIER -63.02 -34.24 77.14 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 -179.341 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.451 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 41.0 p-10 -47.2 -25.48 0.93 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.013 0.435 . . . . 0.0 110.381 -179.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.451 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 12.6 pt-20 -58.76 -40.1 82.93 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.331 179.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.93 -58.05 4.67 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.395 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -46.19 -43.51 15.31 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 121.139 0.495 . . . . 0.0 110.076 -179.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -64.98 -44.69 88.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.696 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -62.64 -39.31 93.46 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.915 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 72.1 t -59.17 -47.19 91.04 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.67 0 CA-C-O 121.855 0.836 . . . . 0.0 109.929 -178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 12.9 mmmt -65.13 -43.74 90.94 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.353 -179.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -74.33 -5.04 39.92 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.096 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.603 ' O ' ' C ' ' A' ' 70' ' ' GLU . . . -106.12 -77.57 1.11 Allowed Glycine 0 N--CA 1.46 0.291 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.603 ' C ' ' O ' ' A' ' 69' ' ' GLY . 2.0 pt-20 6.28 -101.65 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 115.529 -0.335 . . . . 0.0 111.637 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.407 ' H ' ' CG ' ' A' ' 70' ' ' GLU . 67.2 m -158.56 159.25 35.31 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 121.269 0.557 . . . . 0.0 109.745 178.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.526 ' C ' ' H ' ' A' ' 74' ' ' GLU . 27.1 ttmt -90.36 156.59 18.13 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.03 -179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 tp 68.1 -10.9 0.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.213 0.53 . . . . 0.0 110.797 179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.526 ' H ' ' C ' ' A' ' 72' ' ' LYS . 86.7 mt-10 -100.91 61.61 0.97 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.37 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -110.21 152.91 25.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.159 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 98.0 m-70 -76.1 134.03 40.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.501 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 62.2 t-80 -70.15 137.12 50.77 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.439 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.529 ' CG ' ' H ' ' A' ' 79' ' ' HIS . 56.0 t-80 -151.45 174.01 13.89 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.499 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.529 ' H ' ' CG ' ' A' ' 78' ' ' HIS . 97.5 m-70 -58.53 -39.57 80.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.524 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.8 p-80 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 118.056 -0.973 . . . . 0.0 110.438 -179.992 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.2 mmm . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 93.7 p -64.88 149.72 49.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.536 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -91.19 93.94 9.34 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.34 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.52 ' N ' HD12 ' B' ' 4' ' ' LEU . 9.8 mp -71.0 -23.54 62.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.048 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -58.45 -43.08 88.69 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.184 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -62.86 123.04 17.47 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.316 -179.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.539 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.76 -42.33 87.01 Favored Pre-proline 0 CA--C 1.546 0.804 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.601 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 51.5 Cg_exo -54.07 -23.64 29.57 Favored 'Trans proline' 0 N--CA 1.5 1.879 0 C-N-CA 121.476 1.45 . . . . 0.0 112.094 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -67.01 -39.41 87.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.628 0.252 . . . . 0.0 110.573 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.407 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.3 m-85 -60.37 -40.23 90.05 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.102 -179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . 0.45 ' O ' ' N ' ' B' ' 14' ' ' LEU . 96.8 mt -68.13 -45.66 82.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 121.512 0.672 . . . . 0.0 110.796 -179.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -47.76 -25.16 1.15 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.327 -178.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -73.94 -35.37 64.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.053 0.454 . . . . 0.0 110.166 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.45 ' N ' ' O ' ' B' ' 11' ' ' ILE . 29.4 mt -70.89 -39.61 72.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.658 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -57.57 -35.55 70.52 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.099 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -71.33 -28.91 64.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.632 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 52.0 m170 -67.38 -49.88 62.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.66 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 11.4 pt -71.86 -43.5 68.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.843 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 59.1 mm-40 -59.7 -51.55 69.32 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.373 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 52.1 mtm -118.73 -145.34 0.38 Allowed 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.946 0.403 . . . . 0.0 110.366 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -157.49 57.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.344 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 65.2 tp60 -61.11 -45.19 95.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.236 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 4.7 t 177.57 69.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.421 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -169.73 -133.24 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.402 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -151.01 -166.81 2.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.456 0.646 . . . . 0.0 110.269 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -82.23 -109.46 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.423 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.598 HD11 ' HD2' ' B' ' 67' ' ' LYS . 20.4 tt -65.36 -37.46 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 121.091 0.472 . . . . 0.0 110.552 -179.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -57.37 -22.16 40.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.467 -179.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.98 -33.76 2.16 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.639 -179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.611 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -66.18 -52.75 45.16 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.015 178.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.611 ' N ' ' SD ' ' B' ' 30' ' ' MET . 3.0 t-20 -55.35 -50.97 68.26 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.724 -178.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 13.4 t -61.29 -48.34 81.85 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 120.314 -0.554 . . . . 0.0 110.376 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.407 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 60.0 t80 -70.25 -20.74 63.05 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.758 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.558 ' N ' ' O ' ' B' ' 30' ' ' MET . 40.2 t80 -73.09 -53.1 11.91 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.297 -179.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -68.83 -23.0 64.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.495 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 59.4 m -70.0 -47.61 61.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.581 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 66.8 t -70.13 -57.9 6.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 C-N-CA 120.463 -0.495 . . . . 0.0 110.106 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.428 ' O ' HG12 ' B' ' 42' ' ' VAL . 76.8 t -48.57 -44.67 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.428 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 52.8 m -58.49 -34.21 70.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 120.842 0.353 . . . . 0.0 110.434 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 26.0 m -82.25 -45.96 14.32 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.759 0.79 . . . . 0.0 111.372 179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.463 ' CD1' ' CZ ' ' B' ' 55' ' ' ARG . 3.2 mm? -64.21 -43.55 94.66 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.619 -179.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 38' ' ' VAL . 4.3 p -68.17 -20.4 25.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.054 0.455 . . . . 0.0 109.981 -179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -98.84 -15.6 19.18 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.434 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 54.9 t0 -55.64 -47.73 76.14 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -174.8 126.67 0.29 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 110.565 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 25.0 mt -97.31 39.14 1.2 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.258 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 11.3 t -63.69 -25.35 68.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.684 0.754 . . . . 0.0 110.322 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.727 ' O ' HG22 ' B' ' 51' ' ' VAL . 34.5 tptt -169.41 115.2 0.57 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.826 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 48.4 p30 -50.21 -14.29 0.15 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 120.174 -0.61 . . . . 0.0 110.985 179.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.473 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -78.31 -55.1 5.51 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 119.905 -0.718 . . . . 0.0 112.292 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.727 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.3 m -48.35 -37.97 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.837 -179.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 27.3 m -76.35 -33.0 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.588 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.438 HD13 ' O ' ' B' ' 53' ' ' LEU . 0.2 OUTLIER -62.41 -38.33 89.24 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.363 -178.671 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -67.58 -47.15 70.57 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.338 0.59 . . . . 0.0 110.298 -179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.463 ' CZ ' ' CD1' ' B' ' 41' ' ' LEU . 54.8 mtp180 -61.8 -42.89 99.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.2 -179.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 97.0 mt -65.31 -45.02 94.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.218 179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -52.11 -37.78 55.28 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 -179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -67.2 -33.84 76.24 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.02 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.6 ' O ' HD13 ' B' ' 59' ' ' LEU . 0.3 OUTLIER -58.45 -40.82 83.66 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.152 -0.619 . . . . 0.0 110.386 -178.722 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -51.86 -27.25 12.07 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.961 0.41 . . . . 0.0 110.095 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -63.31 -40.94 98.73 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.926 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.34 -53.54 12.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.834 -179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -49.39 -43.05 44.02 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.058 0.456 . . . . 0.0 109.961 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -64.53 -34.77 79.01 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.137 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 tptt -63.68 -34.37 77.71 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.418 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 99.7 t -65.94 -43.0 92.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 122.058 0.932 . . . . 0.0 110.383 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.598 ' HD2' HD11 ' B' ' 27' ' ' ILE . 19.2 mmmt -66.74 -46.01 76.8 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 114.875 -1.057 . . . . 0.0 111.207 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 -76.24 -19.23 58.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.29 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.98 -33.72 9.46 Favored Glycine 0 N--CA 1.471 1.017 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -88.05 -176.48 5.45 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.4 . . . . 0.0 110.265 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 9.5 m -174.21 -178.97 1.54 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.365 0.602 . . . . 0.0 110.079 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -99.41 -36.96 9.41 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.34 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.3 157.43 16.61 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.501 0.667 . . . . 0.0 110.025 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 91.2 mt-10 -145.96 84.61 1.66 Allowed 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.292 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -70.85 122.4 19.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.279 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.423 ' CG ' ' N ' ' B' ' 77' ' ' HIS . 84.2 t60 -171.33 161.6 6.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.439 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.423 ' N ' ' CG ' ' B' ' 76' ' ' HIS . 57.7 t-80 -72.12 133.3 45.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.451 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 -66.97 130.98 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.509 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -70.96 133.54 46.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.559 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 . . . . . 0 C--O 1.22 -0.484 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.567 -179.9 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.529 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 3' ' ' GLU . 49.3 m -87.09 -6.06 58.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.42 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 2' ' ' SER . 23.7 mp0 56.7 152.48 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.649 -179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -178.42 -40.14 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.399 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -63.16 -37.74 88.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.05 0.452 . . . . 0.0 110.306 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 m -61.85 133.57 55.63 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.079 -179.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.515 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -60.08 -44.8 97.41 Favored Pre-proline 0 CA--C 1.54 0.58 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.007 179.453 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.515 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 77.3 Cg_exo -48.58 -22.68 4.56 Favored 'Trans proline' 0 C--N 1.306 -1.7 0 C-N-CA 121.645 1.564 . . . . 0.0 112.169 -179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -73.6 -27.2 61.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.803 0.335 . . . . 0.0 110.519 -179.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' O ' ' CD1' ' A' ' 14' ' ' LEU . 1.0 OUTLIER -82.96 -30.38 28.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.135 179.663 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.0 mt -74.05 -52.83 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-O 121.691 0.758 . . . . 0.0 111.189 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -52.12 -21.68 3.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.397 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -67.94 -37.18 81.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.427 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.684 ' N ' HD12 ' A' ' 14' ' ' LEU . 6.4 mp -69.97 -38.18 76.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.118 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -57.91 -36.7 72.83 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.883 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -62.56 -27.12 68.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 26.8 m170 -70.48 -53.34 16.68 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.983 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.0 pt -71.43 -40.43 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-O 121.088 0.47 . . . . 0.0 110.586 179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -65.3 -53.08 49.22 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.889 -179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.412 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 40.9 mtt -100.16 -65.22 0.98 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.095 0.474 . . . . 0.0 110.33 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.412 ' CB ' ' O ' ' A' ' 20' ' ' MET . 19.6 t30 79.02 43.58 0.07 Allowed 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.933 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -55.41 -44.94 76.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-O 121.054 0.454 . . . . 0.0 110.491 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 99.3 p -150.75 67.37 0.94 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.632 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -166.9 -137.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.536 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -148.22 -163.6 1.82 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.159 0.504 . . . . 0.0 110.354 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.473 ' NZ ' ' OE1' ' A' ' 70' ' ' GLU . 63.0 tttm -85.91 -109.89 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.152 -179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.1 mt -62.25 -40.95 89.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -54.94 -21.35 11.44 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.539 -178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.18 -39.86 30.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.25 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.583 ' SD ' ' N ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -63.2 -46.1 88.59 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 120.511 -0.476 . . . . 0.0 110.571 179.171 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.583 ' N ' ' SD ' ' A' ' 30' ' ' MET . 9.8 t-20 -55.89 -47.89 76.59 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.206 -0.598 . . . . 0.0 110.658 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 61.8 p -65.63 -53.39 42.09 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.456 -0.498 . . . . 0.0 110.804 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.521 ' CE2' HD11 ' A' ' 14' ' ' LEU . 73.3 t80 -62.14 -47.29 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.689 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.441 ' N ' ' O ' ' A' ' 30' ' ' MET . 48.2 t80 -57.51 -48.48 79.16 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 109.697 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.615 ' NH2' ' CD2' ' B' ' 63' ' ' TYR . 6.4 tpt180 -64.32 -30.62 71.66 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 120.797 0.332 . . . . 0.0 110.36 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 36.8 t -69.93 -43.02 72.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.696 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.15 -63.15 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 C-N-CA 119.687 -0.805 . . . . 0.0 110.769 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.517 HG23 ' N ' ' A' ' 39' ' ' SER . 30.9 m -47.21 -42.15 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.678 -179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.517 ' N ' HG23 ' A' ' 38' ' ' VAL . 58.4 m -56.13 -40.36 73.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.828 0.346 . . . . 0.0 110.242 179.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 98.7 m -71.89 -43.3 65.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.702 179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.402 HD22 ' HD2' ' A' ' 55' ' ' ARG . 90.8 mt -62.71 -46.16 89.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.361 -179.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 92.8 t -65.67 -33.1 61.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.096 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -78.9 -18.3 54.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.26 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.938 ' O ' ' O ' ' A' ' 45' ' ' GLN . 42.8 t0 -65.88 169.14 6.98 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 121.217 0.532 . . . . 0.0 109.711 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.938 ' O ' ' O ' ' A' ' 44' ' ' ASP . 14.5 pt20 -13.12 -131.64 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.698 0 CA-C-O 118.51 -0.757 . . . . 0.0 112.684 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 173.75 35.25 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 118.379 0.536 . . . . 0.0 110.066 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.485 ' HB ' HG21 ' A' ' 51' ' ' VAL . 2.6 m -47.32 -49.58 23.73 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.209 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.717 ' O ' HG22 ' A' ' 51' ' ' VAL . 16.0 tptp -169.84 134.29 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.842 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.433 HD22 ' CB ' ' B' ' 50' ' ' ALA . 97.6 m-20 -48.98 -16.04 0.12 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.421 179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.467 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -78.44 -54.82 5.76 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.489 -179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.717 HG22 ' O ' ' A' ' 48' ' ' LYS . 23.9 m -49.99 -39.29 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.534 -179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.3 m -77.5 -40.27 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.171 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 60.6 tp -63.1 -37.61 87.89 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.81 -179.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.452 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 93.3 mttt -58.83 -42.16 88.61 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.163 -179.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.402 ' HD2' HD22 ' A' ' 41' ' ' LEU . 40.6 ttm180 -70.63 -40.94 72.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.442 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.1 mt -62.41 -50.37 80.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.427 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -57.0 -38.55 73.25 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 -179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 54' ' ' LYS . 6.4 m-70 -69.0 -38.7 79.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.735 0.303 . . . . 0.0 110.355 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 34.6 tp -53.48 -24.93 14.39 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.48 -0.488 . . . . 0.0 110.62 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 15.2 p-10 -51.56 -28.36 13.64 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.469 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.452 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 9.1 pt-20 -63.47 -31.9 73.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.504 -179.658 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.66 -60.12 2.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.505 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.22 -39.7 60.58 Favored 'General case' 0 CA--C 1.541 0.635 0 CA-C-O 121.089 0.471 . . . . 0.0 110.415 179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -65.1 -38.82 91.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.481 -178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 47.3 mmtt -63.35 -33.02 74.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.319 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.58 -46.25 90.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.523 0.678 . . . . 0.0 110.509 -179.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.449 ' HZ3' ' HB3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -66.83 -43.19 84.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.471 -179.363 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -87.3 2.63 49.64 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.035 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -114.08 -38.55 1.13 Allowed Glycine 0 N--CA 1.478 1.473 0 N-CA-C 111.047 -0.821 . . . . 0.0 111.047 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.473 ' OE1' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 pp20? -56.69 -35.13 68.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.708 0.29 . . . . 0.0 110.273 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.402 ' N ' ' CD ' ' A' ' 70' ' ' GLU . 11.9 p -60.18 144.35 50.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.188 0.518 . . . . 0.0 110.308 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -164.86 37.18 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.802 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.527 HD12 ' N ' ' A' ' 74' ' ' GLU . 0.3 OUTLIER -97.67 -3.92 38.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.387 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.527 ' N ' HD12 ' A' ' 73' ' ' LEU . 8.3 pt-20 -99.51 -122.0 0.15 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.508 -179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 52.52 13.85 0.35 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.95 0.405 . . . . 0.0 110.648 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.402 ' N ' ' C ' ' A' ' 74' ' ' GLU . 86.3 t60 -91.29 -88.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.245 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 0.455 ' O ' ' O ' ' A' ' 78' ' ' HIS . 85.9 t60 -170.27 -42.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.506 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.455 ' O ' ' O ' ' A' ' 77' ' ' HIS . 82.5 t60 58.76 140.7 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.611 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -57.19 -77.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.885 0.374 . . . . 0.0 110.553 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 84.5 t60 . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.579 -179.995 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.3 mmt . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . 0.42 ' O ' ' O ' ' B' ' 3' ' ' GLU . 77.1 p -64.67 -32.9 74.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.671 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' B' ' 2' ' ' SER . 79.8 tt0 59.44 144.49 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.435 -179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 8.2 tp -170.86 -32.73 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.687 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -59.91 -44.58 94.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.325 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 m -62.85 130.8 46.45 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.171 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.514 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 0.2 OUTLIER -60.86 -44.23 94.18 Favored Pre-proline 0 CA--C 1.543 0.685 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.957 179.42 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 73.7 Cg_exo -50.03 -21.68 6.72 Favored 'Trans proline' 0 C--N 1.305 -1.739 0 C-N-CA 121.703 1.602 . . . . 0.0 112.21 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -64.94 -42.73 94.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.922 0.391 . . . . 0.0 110.497 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.451 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.9 m-85 -60.8 -43.47 98.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.291 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.37 -43.53 97.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.262 0.553 . . . . 0.0 110.472 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -51.34 -28.39 12.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.501 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -70.44 -35.7 73.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.212 0.529 . . . . 0.0 110.575 179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 37.9 mt -67.68 -38.33 83.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.462 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -56.49 -40.77 75.51 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.158 -179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.431 ' O ' ' N ' ' B' ' 20' ' ' MET . 55.5 tt0 -66.56 -34.86 78.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.323 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -64.0 -51.68 63.11 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.754 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.599 HD11 ' OE2' ' B' ' 70' ' ' GLU . 11.0 pt -73.13 -40.9 58.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 CA-C-O 121.111 0.481 . . . . 0.0 110.71 179.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 82.8 tt0 -72.03 -52.51 16.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.773 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.431 ' N ' ' O ' ' B' ' 16' ' ' GLN . 15.3 tpp -87.05 -63.84 1.24 Allowed 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 121.16 0.505 . . . . 0.0 110.45 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 34.7 t-20 69.85 40.77 1.26 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.92 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -53.56 -35.2 60.51 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.058 0.456 . . . . 0.0 110.461 -179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -165.59 64.44 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.657 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -158.6 -132.15 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.333 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -153.05 -176.27 5.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.548 0.689 . . . . 0.0 110.081 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -80.81 -105.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.353 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.561 ' O ' ' SD ' ' B' ' 30' ' ' MET . 5.3 mm -60.33 -39.84 82.1 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -69.21 18.71 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.096 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.54 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -70.82 -49.51 45.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.381 179.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.561 ' SD ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -56.31 -38.01 70.7 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.386 179.815 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.54 ' N ' ' SD ' ' B' ' 30' ' ' MET . 58.5 t-20 -50.69 -44.11 57.83 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.321 -178.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.7 t -74.46 -54.97 6.51 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.719 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.451 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 88.2 t80 -59.04 -49.8 76.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.535 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.539 ' N ' ' O ' ' B' ' 30' ' ' MET . 22.7 t80 -55.31 -45.47 76.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 73.6 ttp85 -63.98 -33.86 76.69 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 34.3 t -68.56 -45.08 73.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.503 -179.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.55 ' O ' ' N ' ' B' ' 41' ' ' LEU . 88.4 t -67.95 -62.7 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.645 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.305 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.52 HG13 ' N ' ' B' ' 39' ' ' SER . 8.0 p -48.17 -44.39 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.607 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.52 ' N ' HG13 ' B' ' 38' ' ' VAL . 50.8 p -57.82 -57.9 10.73 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.427 -0.509 . . . . 0.0 111.054 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 27.3 m -73.59 -43.19 60.34 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 122.39 1.09 . . . . 0.0 111.287 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.55 ' N ' ' O ' ' B' ' 37' ' ' VAL . 41.8 tp -54.14 -41.57 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.37 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 87.1 t -80.46 -16.55 12.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -83.21 -17.09 43.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.465 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.507 ' CG ' ' H ' ' B' ' 45' ' ' GLN . 24.5 t0 -104.75 -151.87 0.45 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.103 0.477 . . . . 0.0 109.715 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.507 ' H ' ' CG ' ' B' ' 44' ' ' ASP . 73.5 tp60 31.9 -93.96 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.152 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' B' ' 44' ' ' ASP . 10.3 mt 54.37 75.2 0.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.178 179.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 14.8 t -136.27 -25.54 1.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.579 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 36.7 tptt -165.06 128.78 2.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -49.48 -33.57 14.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.475 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.433 ' CB ' HD22 ' A' ' 49' ' ' ASN . . . -71.63 -49.98 35.03 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.475 -0.49 . . . . 0.0 111.021 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 30.3 t -50.58 -45.2 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.379 -179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 35.8 m -73.5 -35.88 46.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.804 -179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 55.3 tp -62.58 -39.79 94.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.486 -179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.476 ' O ' ' ND1' ' B' ' 58' ' ' HIS . 93.9 mttt -58.41 -43.01 88.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.23 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 96.3 mtt-85 -68.74 -40.61 79.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.384 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 mm -62.2 -51.38 73.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -54.23 -39.15 66.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.212 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.476 ' ND1' ' O ' ' B' ' 54' ' ' LYS . 32.2 m170 -67.54 -35.05 78.31 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.264 179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.512 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.8 OUTLIER -60.99 -37.65 83.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.254 -179.298 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -55.77 -32.71 63.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.417 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -58.96 -35.12 72.64 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.503 . . . . 0.0 110.453 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.1 -49.62 19.03 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.85 -179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.615 ' CD2' ' NH2' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -52.1 -50.14 62.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.302 0.572 . . . . 0.0 109.746 -179.537 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.424 ' N ' ' CG ' ' B' ' 63' ' ' TYR . 45.4 t30 -62.44 -32.07 72.88 Favored 'General case' 0 CA--C 1.513 -0.478 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.377 -178.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 15.5 tptm -60.57 -36.76 79.3 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.228 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 59.3 t -64.39 -40.04 87.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 123.333 1.54 . . . . 0.0 110.863 -178.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.603 ' C ' ' H ' ' B' ' 69' ' ' GLY . 7.2 mmmt -72.31 -30.67 65.0 Favored 'General case' 0 CA--C 1.505 -0.786 0 CA-C-N 113.637 -1.619 . . . . 0.0 111.496 -178.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 49.2 ttt85 -55.02 1.06 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.608 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.603 ' H ' ' C ' ' B' ' 67' ' ' LYS . . . 97.19 18.53 28.68 Favored Glycine 0 N--CA 1.46 0.235 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.599 ' OE2' HD11 ' B' ' 18' ' ' ILE . 0.0 OUTLIER -59.88 -26.53 65.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.499 0.666 . . . . 0.0 110.145 179.967 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.533 ' HA ' HD12 ' B' ' 18' ' ' ILE . 7.4 t -81.91 -15.34 54.25 Favored 'General case' 0 CA--C 1.509 -0.596 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.561 -178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -135.45 24.56 3.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.532 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.522 ' O ' ' N ' ' B' ' 75' ' ' HIS . 58.7 tp -62.53 -70.89 0.18 Allowed 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.633 0.73 . . . . 0.0 110.084 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.527 ' O ' ' N ' ' B' ' 76' ' ' HIS . 54.3 mt-10 63.45 -57.55 0.18 Allowed 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 121.935 0.874 . . . . 0.0 110.789 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.522 ' N ' ' O ' ' B' ' 73' ' ' LEU . 83.4 t60 58.54 -77.0 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.606 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.527 ' N ' ' O ' ' B' ' 74' ' ' GLU . 84.1 t60 -160.48 133.58 6.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.415 179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 54.8 t-80 -161.09 139.93 10.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.538 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -74.68 144.44 43.77 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.412 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -65.09 -43.48 91.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.467 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 6.6 p80 . . . . . 0 C--O 1.219 -0.501 0 CA-C-O 117.933 -1.032 . . . . 0.0 110.572 -179.971 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.2 p -160.21 164.02 33.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.079 0.466 . . . . 0.0 110.595 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -118.5 52.55 1.02 Allowed 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.696 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.4 -20.16 64.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.268 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -61.91 -44.32 97.03 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.119 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -72.29 135.45 45.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.315 -179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.578 ' N ' ' CD ' ' A' ' 8' ' ' PRO . 1.8 t -68.78 -40.18 16.61 Favored Pre-proline 0 CA--C 1.539 0.549 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.578 ' CD ' ' N ' ' A' ' 7' ' ' VAL . 78.4 Cg_exo -52.08 -27.18 28.2 Favored 'Trans proline' 0 C--N 1.304 -1.806 0 C-N-CA 121.731 1.62 . . . . 0.0 111.883 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -61.71 -41.76 98.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.909 0.385 . . . . 0.0 110.555 -179.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -58.15 -39.04 77.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.053 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.634 HG21 ' HD3' ' A' ' 65' ' ' LYS . 54.6 mt -69.8 -45.91 75.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 CA-C-O 121.451 0.644 . . . . 0.0 110.507 -179.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -49.11 -24.09 1.5 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.806 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -74.92 -30.04 61.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.544 0.688 . . . . 0.0 110.695 179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.426 HD21 ' CG ' ' A' ' 33' ' ' TYR . 25.1 mt -70.04 -39.5 75.69 Favored 'General case' 0 CA--C 1.514 -0.424 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.601 -179.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.6 mtmt -51.22 -39.21 56.08 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.258 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -67.29 -36.52 81.71 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.406 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 m-70 -61.62 -51.42 68.58 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.626 -0.429 . . . . 0.0 110.665 -179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.402 HG13 ' N ' ' A' ' 19' ' ' GLU . 15.2 pt -73.84 -43.77 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.267 0.556 . . . . 0.0 110.958 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.402 ' N ' HG13 ' A' ' 18' ' ' ILE . 83.8 tt0 -65.55 -54.3 30.03 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.672 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.5 mtt -101.03 -160.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.24 0.543 . . . . 0.0 109.861 179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -151.82 47.28 0.79 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.239 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.96 -49.05 74.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.107 0.48 . . . . 0.0 110.462 -179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.0 p -176.2 65.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.404 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.42 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 12.4 tp10 -163.06 -137.02 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.98 0.419 . . . . 0.0 110.203 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -157.79 -166.96 2.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.241 0.544 . . . . 0.0 110.16 -179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -81.81 -103.41 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.56 179.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.551 ' C ' ' H ' ' A' ' 29' ' ' ALA . 4.8 tt -65.12 -36.25 77.34 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 CA-C-N 116.473 -0.331 . . . . 0.0 110.509 -179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.472 ' CG ' ' O ' ' A' ' 28' ' ' HIS . 83.8 t60 -65.65 11.25 0.07 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.678 179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.551 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -80.36 -44.39 19.52 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.921 0.391 . . . . 0.0 110.653 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.493 ' O ' ' N ' ' A' ' 34' ' ' TYR . 12.3 ptt? -58.8 -47.9 83.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.164 -179.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.466 ' N ' ' CG ' ' A' ' 30' ' ' MET . 12.2 m120 -53.06 -53.91 43.31 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.809 -178.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.42 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 73.3 m -57.99 -51.25 70.45 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.446 -0.502 . . . . 0.0 110.512 179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' CE1' HD11 ' A' ' 59' ' ' LEU . 0.3 OUTLIER -64.64 -25.52 67.99 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.124 179.274 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.493 ' N ' ' O ' ' A' ' 30' ' ' MET . 53.9 t80 -71.64 -55.43 7.76 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 121.054 0.454 . . . . 0.0 110.358 -178.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -65.98 -24.71 66.84 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.454 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 40.0 t -67.23 -51.61 51.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.69 -179.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.45 -55.42 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 79.6 t -49.48 -53.32 9.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 C-N-CA 120.617 -0.433 . . . . 0.0 110.662 -179.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 70.8 m -50.35 -56.68 10.27 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.842 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 44' ' ' ASP . 18.9 m -61.51 -42.9 99.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.208 0.528 . . . . 0.0 110.521 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.771 HD21 HH11 ' A' ' 55' ' ' ARG . 0.2 OUTLIER -59.96 -44.4 94.46 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.409 -178.508 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 82.6 t -73.55 -40.0 54.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.027 0.442 . . . . 0.0 110.276 179.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -73.01 -21.39 60.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.708 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.595 ' CG ' ' H ' ' A' ' 45' ' ' GLN . 26.7 t70 -101.36 -152.07 0.43 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.097 0.475 . . . . 0.0 110.008 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.595 ' H ' ' CG ' ' A' ' 44' ' ' ASP . 5.9 tp-100 30.42 -91.97 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.412 0.625 . . . . 0.0 111.425 -179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.484 ' N ' ' O ' ' A' ' 44' ' ' ASP . 7.3 mt 56.74 101.29 0.02 OUTLIER 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.041 178.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.519 HG22 HG21 ' A' ' 51' ' ' VAL . 12.1 t -168.29 -28.13 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.897 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.817 ' O ' HG22 ' A' ' 51' ' ' VAL . 38.1 tptt -164.15 129.38 2.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.87 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.52 -18.1 1.01 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.989 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.422 ' H ' ' HG3' ' A' ' 48' ' ' LYS . . . -75.9 -57.04 4.11 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.577 -0.849 . . . . 0.0 111.869 -179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.817 HG22 ' O ' ' A' ' 48' ' ' LYS . 28.7 m -46.64 -36.31 2.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.755 -179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 HG23 ' A' ' 51' ' ' VAL . 34.1 m -81.72 -33.76 12.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.515 178.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 39.4 tp -57.3 -55.86 29.34 Favored 'General case' 0 CA--C 1.516 -0.328 0 C-N-CA 120.364 -0.535 . . . . 0.0 110.813 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.444 ' CG ' ' N ' ' A' ' 55' ' ' ARG . 18.9 ptmt -52.62 -42.55 64.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.317 0.58 . . . . 0.0 110.291 -178.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.771 HH11 HD21 ' A' ' 41' ' ' LEU . 25.8 mmt85 -61.14 -40.95 95.76 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.753 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.1 mm -69.68 -49.57 57.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.312 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -56.02 -46.08 78.92 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.495 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 59.4 m170 -66.98 -45.32 78.0 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.245 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.578 HD11 ' CE1' ' A' ' 33' ' ' TYR . 38.8 tp -50.2 -24.86 3.09 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.794 -179.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -62.93 -32.99 74.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.241 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -62.34 -39.55 93.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.715 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -58.29 5.71 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.571 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.418 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -54.05 -42.07 68.82 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.02 0.438 . . . . 0.0 109.877 -179.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.418 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 59.8 t-20 -66.02 -40.87 91.44 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.588 -178.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.634 ' HD3' HG21 ' A' ' 11' ' ' ILE . 62.7 tttm -61.49 -39.59 91.5 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.44 -179.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 75.0 t -53.55 -59.88 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.502 -0.479 . . . . 0.0 110.454 -179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.407 ' C ' ' N ' ' A' ' 69' ' ' GLY . 32.0 mtmt -62.45 -46.42 88.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.977 0.894 . . . . 0.0 111.437 -179.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 69.6 ttt-85 -52.11 -15.67 0.62 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.034 -0.985 . . . . 0.0 110.052 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.407 ' N ' ' C ' ' A' ' 67' ' ' LYS . . . -101.16 -13.76 32.67 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -100.79 -101.41 0.25 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.648 0.261 . . . . 0.0 110.369 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.5 t 52.96 36.82 22.95 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.227 0.537 . . . . 0.0 110.658 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -97.98 -21.72 16.68 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.51 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 30.4 mt -95.58 0.78 53.32 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.462 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -160.26 44.44 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.59 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 86.3 t60 -64.44 -50.19 68.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.323 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 64.0 m80 47.23 -172.48 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.581 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -106.1 124.56 49.77 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.155 0.502 . . . . 0.0 110.311 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -74.21 144.43 44.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.28 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 76.3 m80 52.93 85.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.639 -179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 82.4 t60 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.473 -179.876 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.2 mmm . . . . . 0 N--CA 1.491 1.617 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 97.1 p -159.95 158.96 31.66 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.467 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 tp10 -80.17 134.28 36.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.155 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 mt 51.76 -165.58 0.05 Allowed 'General case' 0 CA--C 1.515 -0.393 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.619 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.515 ' O ' ' CB ' ' B' ' 6' ' ' SER . 98.1 m-85 44.26 77.39 0.07 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.33 0.586 . . . . 0.0 109.997 -179.308 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.515 ' CB ' ' O ' ' B' ' 5' ' ' PHE . 2.3 p 152.33 77.89 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.243 179.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.476 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 3.5 t -35.25 -54.67 1.12 Allowed Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.076 177.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 19.3 Cg_endo -53.37 -22.24 20.24 Favored 'Trans proline' 0 C--N 1.306 -1.684 0 C-N-CA 121.366 1.377 . . . . 0.0 112.44 179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . 0.504 ' N ' ' O ' ' B' ' 6' ' ' SER . 12.4 t80 -66.98 -44.76 79.6 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.769 -179.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.465 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 3.1 m-85 -71.66 -46.42 58.99 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.759 -179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 40.1 mt -61.14 -44.83 99.1 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 120.799 -0.36 . . . . 0.0 110.275 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -49.8 -31.39 11.6 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.231 -179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . 0.465 ' ND2' ' NE2' ' B' ' 17' ' ' HIS . 5.4 t-20 -71.38 -43.44 66.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.047 0.451 . . . . 0.0 110.386 179.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.406 HD21 ' CD2' ' B' ' 33' ' ' TYR . 46.2 mt -62.67 -39.09 92.83 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.244 -179.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -57.8 -39.52 77.73 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.258 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 55.7 tt0 -75.2 -28.22 59.92 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.014 0.435 . . . . 0.0 110.696 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.465 ' NE2' ' ND2' ' B' ' 13' ' ' ASN . 34.7 m170 -65.43 -51.49 59.87 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.84 -179.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.448 ' CG1' ' N ' ' B' ' 19' ' ' GLU . 3.7 pt -73.08 -44.55 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 121.085 0.469 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.448 ' N ' ' CG1' ' B' ' 18' ' ' ILE . 72.0 mm-40 -67.48 -50.43 59.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.129 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 11.0 tpp -94.0 -152.81 0.35 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.538 0.685 . . . . 0.0 109.98 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -163.97 41.92 0.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.003 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 54.5 tt0 -55.25 -50.5 69.32 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.237 0.541 . . . . 0.0 110.491 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 36.7 p -174.62 65.86 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.289 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -162.86 -146.9 0.11 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.913 0.387 . . . . 0.0 110.403 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -144.44 -163.41 1.68 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.113 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -81.54 -108.07 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.648 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . . . . . . . . . 4.5 mt -64.72 -42.26 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 120.56 -0.456 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -50.16 -28.79 7.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.616 -178.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -44.82 -31.67 1.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.728 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.551 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.1 OUTLIER -65.82 -50.69 63.71 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.355 178.399 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.551 ' N ' ' SD ' ' B' ' 30' ' ' MET . 10.8 t30 -57.56 -56.73 18.11 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.964 -178.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 63.7 p -54.54 -45.57 73.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.549 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 76.3 t80 -70.15 -34.53 73.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.538 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' B' ' 30' ' ' MET . 25.3 t80 -61.65 -47.81 83.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.048 -0.523 . . . . 0.0 109.612 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.482 ' NH1' ' OD1' ' B' ' 31' ' ' ASN . 10.7 mpt_? -69.51 -26.48 64.55 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 42.2 t -68.68 -46.38 69.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.678 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 53.8 t -64.89 -66.12 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.544 -0.863 . . . . 0.0 110.835 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.491 HG23 ' N ' ' B' ' 39' ' ' SER . 25.1 m -44.6 -39.82 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.577 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.491 ' N ' HG23 ' B' ' 38' ' ' VAL . 11.0 t -60.73 -44.93 96.02 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.142 179.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 28.7 m -69.67 -46.47 66.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 0.0 110.998 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.413 ' O ' ' O ' ' B' ' 44' ' ' ASP . 4.2 mm? -60.28 -33.74 72.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.46 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -87.63 -37.58 10.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 55.2 tt0 -73.12 -14.97 61.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.672 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.413 ' O ' ' O ' ' B' ' 41' ' ' LEU . 33.6 t70 -143.67 160.52 40.55 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-O 121.484 0.659 . . . . 0.0 110.051 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 41.25 63.35 1.25 Allowed 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.083 -179.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -110.87 42.11 1.68 Allowed 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.56 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . 0.493 HG22 HG21 ' B' ' 51' ' ' VAL . 9.1 t -54.92 -44.01 73.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.764 0.792 . . . . 0.0 110.455 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.809 ' O ' HG22 ' B' ' 51' ' ' VAL . 38.2 tptt -146.81 127.44 14.22 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.881 179.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -50.19 -15.03 0.19 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.939 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.409 ' H ' ' HG3' ' B' ' 48' ' ' LYS . . . -77.08 -55.79 5.14 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.019 -0.672 . . . . 0.0 111.596 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.809 HG22 ' O ' ' B' ' 48' ' ' LYS . 28.2 m -48.08 -38.0 7.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.773 -179.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.1 m -78.68 -34.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.144 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.14 -42.25 90.24 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.427 -179.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -56.29 -43.81 79.23 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.018 -179.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -63.29 -45.06 93.14 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.494 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 84.3 mt -62.93 -52.04 64.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.786 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -55.32 -41.39 72.34 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.391 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 15.7 m-70 -74.21 -38.83 63.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.004 0.43 . . . . 0.0 110.331 -179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 5.8 tt -52.63 -26.2 12.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.082 -179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -52.43 -28.59 20.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.438 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -66.46 -32.85 74.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.91 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.75 -62.92 1.21 Allowed 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.748 -179.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -47.49 -38.97 14.87 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -65.07 -38.55 91.15 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.128 0.49 . . . . 0.0 110.071 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.484 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.2 tptp -63.33 -33.07 74.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.179 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 60.6 t -62.57 -46.75 95.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 121.928 0.87 . . . . 0.0 110.466 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.4 mmmt -71.52 -43.0 67.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 122.203 1.001 . . . . 0.0 112.011 -179.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 29.6 mmm-85 -79.09 -14.14 59.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.478 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -95.88 -42.12 3.65 Favored Glycine 0 N--CA 1.469 0.893 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -67.14 -31.75 72.4 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 120.802 0.334 . . . . 0.0 110.329 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 11.5 p -71.83 150.28 44.45 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.109 0.48 . . . . 0.0 110.03 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.431 ' O ' ' C ' ' B' ' 73' ' ' LEU . 31.0 mmtp 45.02 -167.55 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.067 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.431 ' C ' ' O ' ' B' ' 72' ' ' LYS . 1.5 tt 34.35 69.99 0.14 Allowed 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.976 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -67.3 -50.56 59.75 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.345 -179.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.462 ' O ' ' CG ' ' B' ' 76' ' ' HIS . 84.8 t60 -171.83 144.47 1.78 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.481 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.462 ' CG ' ' O ' ' B' ' 75' ' ' HIS . 58.9 m80 -157.75 108.94 2.26 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.433 179.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . 0.405 ' ND1' ' O ' ' B' ' 78' ' ' HIS . 60.2 t-80 -157.88 146.33 19.08 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.405 ' O ' ' ND1' ' B' ' 77' ' ' HIS . 75.1 m80 -70.3 137.34 50.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.379 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 99.8 m-70 -70.95 156.95 39.0 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.483 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.887 -179.807 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.6 ptt? . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.7 p 50.7 97.02 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.401 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.532 ' C ' ' H ' ' A' ' 5' ' ' PHE . 4.6 tt0 57.03 -168.87 0.11 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.623 0.725 . . . . 0.0 110.0 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' HB3' ' O ' ' A' ' 3' ' ' GLU . 45.4 tp 67.79 -39.93 0.4 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.56 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.532 ' H ' ' C ' ' A' ' 3' ' ' GLU . 74.3 t80 -59.61 -44.53 93.38 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.254 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m -65.54 125.48 25.34 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 121.22 0.533 . . . . 0.0 110.352 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.528 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -52.42 -50.25 80.97 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.143 179.07 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.528 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 58.1 Cg_exo -41.59 -27.64 0.53 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 C-N-CA 121.845 1.697 . . . . 0.0 112.32 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 83.5 t80 -60.48 -39.43 87.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.107 0.479 . . . . 0.0 110.205 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.412 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 1.8 m-85 -58.05 -47.05 84.3 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.157 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 57.8 mt -66.1 -47.14 85.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 121.465 0.65 . . . . 0.0 110.62 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -50.61 -28.55 8.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.62 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 65.1 m-20 -72.36 -37.78 68.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.37 0.605 . . . . 0.0 110.648 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 14.3 mt -67.53 -35.19 78.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.163 -179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -52.16 -41.85 62.92 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.34 -179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 54.3 tt0 -68.01 -36.46 80.0 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.834 0.35 . . . . 0.0 110.675 179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.2 m-70 -59.1 -49.3 78.41 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.721 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.451 HG13 ' N ' ' A' ' 19' ' ' GLU . 27.0 pt -73.24 -41.43 58.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.783 179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.451 ' N ' HG13 ' A' ' 18' ' ' ILE . 47.6 tp10 -55.06 -53.98 48.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.311 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 17.9 ptp -121.25 -134.59 0.31 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.241 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -159.88 53.75 0.35 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.159 -179.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 -55.7 -46.41 77.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.3 -179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.0 p -175.42 57.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.421 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -164.71 -139.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 121.014 0.435 . . . . 0.0 110.285 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -147.86 -166.3 2.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.349 0.595 . . . . 0.0 110.54 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.5 -105.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.471 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.5 HG23 ' N ' ' A' ' 28' ' ' HIS . 17.4 tt -63.96 -41.83 93.76 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.163 -179.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.5 ' N ' HG23 ' A' ' 27' ' ' ILE . 95.5 m-70 -55.65 -11.58 0.97 Allowed 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.592 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -49.84 -42.83 48.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.593 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 34' ' ' TYR . 1.1 ptm -65.98 -54.76 22.03 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.194 179.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.441 ' H ' ' HG3' ' A' ' 30' ' ' MET . 19.0 t-20 -51.61 -47.83 63.48 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.495 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.9 t -68.31 -54.54 16.72 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.648 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.412 ' OH ' ' CD2' ' A' ' 10' ' ' PHE . 42.8 t80 -60.63 -48.97 79.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.642 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.739 ' O ' HG23 ' A' ' 38' ' ' VAL . 66.3 t80 -51.88 -43.27 63.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.791 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 55.6 ttm-85 -77.16 -26.58 53.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.049 0.452 . . . . 0.0 110.604 179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.0 m -64.79 -46.83 80.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.771 -179.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.526 HG23 ' N ' ' A' ' 38' ' ' VAL . 26.6 m -76.23 -44.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.526 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.739 HG23 ' O ' ' A' ' 34' ' ' TYR . 24.6 t -46.61 -43.33 5.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.207 -178.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.0 p -58.61 -35.09 71.92 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.029 0.443 . . . . 0.0 110.506 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.493 ' O ' ' N ' ' A' ' 44' ' ' ASP . 95.6 m -85.82 -45.22 11.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.723 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' C ' ' H ' ' A' ' 43' ' ' GLN . 4.4 mm? -63.21 -45.73 90.31 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.039 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 38' ' ' VAL . 2.8 p -68.67 3.99 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.614 -0.435 . . . . 0.0 110.294 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 41' ' ' LEU . 57.1 tt0 -129.28 -23.34 2.98 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.255 -179.474 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' A' ' 40' ' ' THR . 23.4 t0 -57.79 121.88 11.54 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-O 121.25 0.548 . . . . 0.0 110.035 -179.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.452 ' C ' ' O ' ' A' ' 44' ' ' ASP . 11.2 pt20 31.58 89.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.154 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.281 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -77.23 45.71 0.47 Allowed 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.393 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 1.5 t -59.17 -31.37 68.93 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.388 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HG2' ' HB3' ' A' ' 50' ' ' ALA . 5.8 ttmt -165.79 131.21 2.46 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.228 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -50.04 -32.1 14.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.404 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.508 ' N ' HD22 ' B' ' 49' ' ' ASN . . . -72.42 -48.72 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.386 0.612 . . . . 0.0 110.601 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.1 t -49.13 -42.42 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.751 -179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.402 ' H ' HG22 ' A' ' 52' ' ' VAL . 25.6 m -75.44 -36.36 35.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.209 0.528 . . . . 0.0 110.295 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -35.82 82.19 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.938 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.471 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 59.3 mttp -53.26 -41.98 66.04 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.301 -179.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.4 mmm-85 -65.26 -36.66 84.79 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.321 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 41.2 mm -66.84 -51.67 52.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.297 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.738 -179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.42 ' O ' ' OD1' ' A' ' 60' ' ' ASP . 77.6 mt-30 -55.37 -40.26 71.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.348 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.471 ' ND1' ' O ' ' A' ' 54' ' ' LYS . 38.1 m80 -75.73 -40.05 56.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.546 179.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.4 HD23 ' CE1' ' A' ' 34' ' ' TYR . 62.2 tp -51.51 -30.89 21.87 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.742 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.549 ' OD1' ' N ' ' A' ' 61' ' ' GLU . 11.6 p-10 -52.88 -28.4 22.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.38 0.609 . . . . 0.0 110.624 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.549 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 7.7 pt-20 -57.93 -36.66 72.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.366 -179.448 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' O ' HG23 ' A' ' 66' ' ' VAL . . . -71.6 -53.82 12.47 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.4 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.441 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.0 OUTLIER -48.95 -41.36 33.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.208 -179.842 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.441 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 39.5 m-80 -68.09 -41.64 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.295 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 23.3 mmtp -65.53 -34.81 79.12 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.433 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 62' ' ' ALA . 89.7 t -60.78 -62.31 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.513 -179.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.7 mtmt -60.71 -51.86 67.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 120.349 -0.54 . . . . 0.0 111.148 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 67.7 ttp85 -55.43 -11.86 0.95 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.179 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -101.83 -28.41 6.62 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 57.6 mm-40 -53.77 -100.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.693 0.282 . . . . 0.0 110.638 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.2 m -164.83 -131.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.342 0.591 . . . . 0.0 110.215 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -65.8 -130.96 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.355 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.485 ' N ' HD12 ' A' ' 73' ' ' LEU . 11.1 mp 44.85 58.77 3.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.686 -179.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.418 ' O ' ' O ' ' A' ' 75' ' ' HIS . 6.3 pt-20 -148.82 -36.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.653 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.418 ' O ' ' O ' ' A' ' 74' ' ' GLU . 0.9 OUTLIER 59.62 146.78 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.982 0.42 . . . . 0.0 110.363 -179.759 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 17.2 p80 -115.62 45.36 1.7 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.652 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 56.6 t-80 -110.83 110.03 20.47 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.206 0.527 . . . . 0.0 110.397 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -157.44 156.47 32.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.556 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.5 p-80 -68.01 130.35 42.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.559 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.582 -179.962 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 34.9 t -64.91 -26.37 68.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.4 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -74.0 139.07 44.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.688 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.41 HD12 ' N ' ' B' ' 5' ' ' PHE . 0.4 OUTLIER -161.21 9.47 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.392 -179.586 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.41 ' N ' HD12 ' B' ' 4' ' ' LEU . 60.1 t80 -59.9 -44.36 94.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.014 0.435 . . . . 0.0 110.33 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.48 131.73 50.12 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.302 -179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.713 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 25.3 t -58.81 -48.58 96.56 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.257 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.713 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 7.4 Cg_endo -47.5 -25.76 5.55 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 121.969 1.779 . . . . 0.0 112.077 -179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -62.45 -41.23 98.6 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.217 0.532 . . . . 0.0 110.449 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.434 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 2.5 m-85 -59.36 -40.65 87.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.253 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 72.3 mt -70.04 -43.47 79.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.306 0.574 . . . . 0.0 110.501 -179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -50.63 -28.78 9.5 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.542 -179.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -73.25 -33.28 65.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.034 0.445 . . . . 0.0 110.483 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.431 HD13 ' CG2' ' B' ' 66' ' ' VAL . 25.7 mt -72.0 -38.95 69.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.545 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -56.74 -38.61 72.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.191 -179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.435 ' O ' ' N ' ' B' ' 20' ' ' MET . 56.7 tt0 -66.98 -35.81 80.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.533 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -63.22 -51.86 64.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.949 0.404 . . . . 0.0 110.69 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.438 HG13 ' N ' ' B' ' 19' ' ' GLU . 11.8 pt -72.53 -44.42 61.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.787 179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.438 ' N ' HG13 ' B' ' 18' ' ' ILE . 83.2 tt0 -68.85 -53.98 18.33 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.322 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.435 ' N ' ' O ' ' B' ' 16' ' ' GLN . 11.2 tpp -86.75 -153.55 0.21 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.196 0.522 . . . . 0.0 110.195 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -162.27 36.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.515 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 -46.06 -63.16 1.05 Allowed 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.995 0.426 . . . . 0.0 110.637 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 39.6 p -172.41 65.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.48 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . 0.418 ' OE2' ' OG ' ' B' ' 32' ' ' SER . 19.1 tp10 -154.92 -131.33 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.025 0.44 . . . . 0.0 110.359 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 65.1 m-20 -160.37 -173.86 4.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.343 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . 0.462 ' NZ ' ' OE2' ' B' ' 74' ' ' GLU . 85.9 tttt -74.35 -106.36 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.604 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.562 ' C ' ' H ' ' B' ' 29' ' ' ALA . 19.0 mt -66.0 -33.49 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 58.3 m80 -64.01 8.67 0.09 Allowed 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.859 -179.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.562 ' H ' ' C ' ' B' ' 27' ' ' ILE . . . -77.46 -43.56 31.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.742 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.417 ' CG ' ' O ' ' B' ' 27' ' ' ILE . 0.0 OUTLIER -58.82 -46.86 86.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.058 -179.749 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -51.99 -48.75 64.27 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.393 -179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.418 ' OG ' ' OE2' ' B' ' 24' ' ' GLU . 65.7 p -67.78 -55.68 12.13 Favored 'General case' 0 C--N 1.33 -0.283 0 C-N-CA 120.317 -0.553 . . . . 0.0 110.907 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.622 ' CE2' HG21 ' B' ' 37' ' ' VAL . 86.2 t80 -56.78 -47.49 80.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.596 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -58.16 -44.2 87.81 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.936 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -61.97 -35.46 78.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.281 0.563 . . . . 0.0 110.788 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.2 p -73.92 -44.25 55.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.66 -179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.622 HG21 ' CE2' ' B' ' 33' ' ' TYR . 50.0 t -69.96 -57.1 9.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.619 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.475 HG13 ' N ' ' B' ' 39' ' ' SER . 5.8 p -48.61 -41.52 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.033 0.444 . . . . 0.0 110.396 -179.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.475 ' N ' HG13 ' B' ' 38' ' ' VAL . 42.6 t -64.67 -38.17 90.07 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.265 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . 0.409 ' O ' ' N ' ' B' ' 44' ' ' ASP . 89.0 m -71.95 -44.06 64.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.385 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -56.66 -44.04 80.98 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.567 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 82.0 t -73.37 -32.4 37.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 65.9 tp60 -77.65 -35.11 52.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.218 0.532 . . . . 0.0 110.61 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.409 ' N ' ' O ' ' B' ' 40' ' ' THR . 98.8 m-20 -39.12 -68.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -174.53 139.67 0.58 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.571 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.556 ' N ' HD12 ' B' ' 46' ' ' LEU . 9.5 mp -96.04 48.32 1.11 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.341 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 3.2 t -61.56 -36.01 79.4 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.004 0.43 . . . . 0.0 110.6 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.527 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -166.61 128.48 1.77 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.62 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . 0.511 ' OD1' ' N ' ' B' ' 50' ' ' ALA . 24.4 p30 -47.91 -34.65 9.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.572 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.527 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -65.79 -49.59 67.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.007 0.432 . . . . 0.0 110.813 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . 0.412 ' O ' ' HG2' ' B' ' 54' ' ' LYS . 22.4 t -50.96 -43.98 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.71 -179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 30.2 m -80.68 -37.28 16.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.119 0.485 . . . . 0.0 110.65 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.15 -47.34 83.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.938 -178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.461 ' CG ' ' N ' ' B' ' 55' ' ' ARG . 16.7 pttp -54.16 -41.29 68.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.579 0.704 . . . . 0.0 110.27 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.461 ' N ' ' CG ' ' B' ' 54' ' ' LYS . 27.2 mmt180 -65.35 -37.91 88.48 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.136 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 6.0 mm -66.17 -48.56 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.684 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 -56.18 -41.86 76.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.405 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 -69.17 -38.9 78.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.384 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . 0.548 HD23 ' O ' ' B' ' 59' ' ' LEU . 0.9 OUTLIER -53.83 -36.32 62.41 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.572 -178.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 -53.82 -27.43 29.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.438 -179.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -64.51 -37.95 89.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.452 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.6 -53.65 10.0 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.404 -179.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' B' ' 64' ' ' ASN . 0.0 OUTLIER -51.34 -39.63 57.43 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.056 -179.688 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . 0.453 ' N ' ' CD1' ' B' ' 63' ' ' TYR . 49.7 t30 -71.02 -38.17 72.63 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.251 -178.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 43.0 mmtt -59.66 -32.13 70.19 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.438 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.431 ' CG2' HD13 ' B' ' 14' ' ' LEU . 98.7 t -64.67 -60.77 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.679 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.46 -179.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 40.3 mtmt -67.83 -45.13 75.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.372 0.606 . . . . 0.0 110.985 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 15.4 tpt180 -54.55 -23.21 15.68 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.313 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -88.89 -7.63 70.55 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 -179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -101.73 174.84 5.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.29 0.567 . . . . 0.0 110.37 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 37.1 t -161.9 -178.89 6.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.333 -179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -86.86 -44.12 11.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.469 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.526 ' N ' HD22 ' B' ' 73' ' ' LEU . 4.2 mm? -56.69 -50.35 72.39 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.838 -178.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.462 ' OE2' ' NZ ' ' B' ' 26' ' ' LYS . 96.9 mt-10 54.08 57.42 5.96 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.541 179.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.517 ' CG ' ' N ' ' B' ' 76' ' ' HIS . 82.7 t60 -62.3 169.11 3.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.396 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.517 ' N ' ' CG ' ' B' ' 75' ' ' HIS . 99.4 m-70 -75.37 64.2 1.51 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.495 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -62.25 -42.74 99.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.54 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 51.0 m170 52.27 -168.51 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.622 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 79.6 m80 -152.24 54.65 0.81 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.545 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 24.6 p80 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.039 -0.982 . . . . 0.0 110.532 179.916 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 79.4 mtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.8 t -166.5 -76.72 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.512 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 51.12 79.11 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.365 -179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.5 tt -158.42 102.93 1.76 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.13 0.49 . . . . 0.0 110.322 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -95.47 67.28 2.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.178 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.495 ' OG ' ' N ' ' A' ' 7' ' ' VAL . 29.8 t 51.73 -160.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.935 0.398 . . . . 0.0 110.578 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.538 ' N ' ' HD2' ' A' ' 8' ' ' PRO . 2.6 t -51.71 -55.63 28.23 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.037 -0.528 . . . . 0.0 109.6 178.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 28.1 Cg_exo -36.12 -26.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.731 0 C-N-CA 122.353 2.035 . . . . 0.0 112.479 -178.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.518 ' N ' ' O ' ' A' ' 7' ' ' VAL . 88.4 t80 -60.7 -43.11 98.2 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.394 179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.433 ' CD2' ' OH ' ' A' ' 33' ' ' TYR . 0.4 OUTLIER -56.46 -47.99 78.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.7 mt -63.55 -45.09 98.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.415 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -51.65 -25.19 6.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.672 -179.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -70.32 -36.4 74.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 110.48 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.615 ' N ' HD12 ' A' ' 14' ' ' LEU . 8.3 mp -68.41 -37.75 80.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.204 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -60.33 -39.35 86.77 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.259 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -55.23 -26.6 40.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.619 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -73.74 -53.74 9.66 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.381 -0.528 . . . . 0.0 110.849 -179.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.439 ' CG1' ' N ' ' A' ' 19' ' ' GLU . 3.1 pt -71.54 -42.89 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 121.493 0.664 . . . . 0.0 110.878 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.439 ' N ' ' CG1' ' A' ' 18' ' ' ILE . 79.4 mm-40 -62.17 -53.03 61.14 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.179 -179.055 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.3 mtt -103.05 -141.07 0.36 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 121.088 0.471 . . . . 0.0 110.081 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -169.84 56.5 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.151 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -51.61 63.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.193 0.52 . . . . 0.0 110.613 -179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.2 t 179.38 73.35 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.211 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.447 ' OE2' ' CB ' ' A' ' 32' ' ' SER . 6.3 tp10 -164.6 -132.29 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.995 0.426 . . . . 0.0 110.397 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -149.66 -172.18 4.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.46 0.648 . . . . 0.0 110.213 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' HG22 ' A' ' 18' ' ' ILE . 59.7 tttp -79.75 -108.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.83 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.615 ' O ' ' SD ' ' A' ' 30' ' ' MET . 20.0 tt -61.52 -37.52 78.02 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.887 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.422 ' N ' HG23 ' A' ' 27' ' ' ILE . 98.3 m-70 -69.56 20.02 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.067 0.46 . . . . 0.0 111.018 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.552 ' H ' ' C ' ' A' ' 27' ' ' ILE . . . -73.9 -45.91 47.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.456 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.615 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -59.66 -38.97 82.89 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.376 -179.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.56 ' N ' ' SD ' ' A' ' 30' ' ' MET . 18.5 m120 -51.4 -44.96 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.272 -177.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.447 ' CB ' ' OE2' ' A' ' 24' ' ' GLU . 6.8 t -73.32 -54.5 8.21 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.411 -0.516 . . . . 0.0 110.813 179.547 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.477 ' CD1' HD11 ' A' ' 14' ' ' LEU . 64.7 t80 -59.62 -50.66 73.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.542 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 30' ' ' MET . 44.1 t80 -54.9 -40.8 70.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.818 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 74.3 ttt-85 -72.33 -27.15 62.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.848 0.356 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 21.0 p -70.59 -44.37 67.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.404 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.518 ' O ' ' N ' ' A' ' 41' ' ' LEU . 59.3 t -66.09 -63.82 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.504 -0.791 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.212 -179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.562 ' O ' HG23 ' A' ' 42' ' ' VAL . 26.3 m -47.18 -43.7 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.965 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.546 ' N ' HG23 ' A' ' 38' ' ' VAL . 11.5 t -53.27 -59.1 4.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.844 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 32.7 m -77.73 -41.55 37.33 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-O 121.993 0.902 . . . . 0.0 111.277 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' A' ' 37' ' ' VAL . 40.7 tp -55.17 -41.34 71.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.047 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.562 HG23 ' O ' ' A' ' 38' ' ' VAL . 55.0 t -68.25 -3.85 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 120.912 0.387 . . . . 0.0 110.173 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.555 ' O ' ' C ' ' A' ' 44' ' ' ASP . 11.3 tp-100 -113.07 -29.56 7.28 Favored 'General case' 0 CA--C 1.5 -0.963 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.035 -179.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.555 ' C ' ' O ' ' A' ' 43' ' ' GLN . 46.7 t0 -17.81 -78.92 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.188 0.518 . . . . 0.0 111.341 -179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.421 ' O ' ' C ' ' A' ' 46' ' ' LEU . 27.5 pt20 -142.89 0.5 1.23 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.554 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.421 ' C ' ' O ' ' A' ' 45' ' ' GLN . 5.5 tp 34.18 50.39 0.36 Allowed 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.099 0.476 . . . . 0.0 110.722 -179.38 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -56.21 -28.49 58.51 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.606 -178.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.529 ' HG2' ' H ' ' A' ' 50' ' ' ALA . 62.2 tttp -178.66 143.92 0.26 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.324 -178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -57.71 -38.82 75.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.694 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.529 ' H ' ' HG2' ' A' ' 48' ' ' LYS . . . -68.44 -49.88 56.69 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.396 -0.521 . . . . 0.0 110.75 179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 34.4 t -51.15 -65.08 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.934 -178.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.08 -31.95 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.275 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.52 -42.52 98.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.101 0.476 . . . . 0.0 110.402 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -59.99 -40.28 88.61 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.134 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.0 mtp85 -66.63 -39.45 88.29 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.317 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.25 -48.88 81.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.66 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -57.15 -33.02 66.98 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.134 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.464 ' CD2' ' OE1' ' A' ' 61' ' ' GLU . 4.6 t-80 -74.54 -40.49 61.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.027 179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 43.0 tp -57.2 -29.24 63.54 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 121.067 0.46 . . . . 0.0 110.532 -178.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -51.38 -30.65 19.63 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.75 -179.288 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' OE1' ' CD2' ' A' ' 58' ' ' HIS . 7.5 pt-20 -60.72 -28.97 69.07 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.532 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.21 -59.67 2.74 Favored 'General case' 0 CA--C 1.511 -0.538 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.368 -179.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -42.98 66.71 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.348 0.594 . . . . 0.0 110.218 -179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -62.69 -39.02 92.66 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.2 -178.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.7 tptm -63.6 -38.53 91.46 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.502 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 73.1 t -62.04 -50.89 78.24 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.621 0 CA-C-O 121.336 0.588 . . . . 0.0 110.355 -178.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.88 -47.31 78.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 121.689 0.757 . . . . 0.0 111.304 -179.55 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -56.16 -18.38 9.9 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.071 -179.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.44 -18.41 52.62 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -81.05 -100.35 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 77.7 p -73.28 98.34 2.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.012 0.434 . . . . 0.0 110.635 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -68.32 -106.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.34 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.457 ' C ' ' H ' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -89.11 63.03 6.47 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.373 0.606 . . . . 0.0 110.479 179.809 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.36 -3.43 0.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.067 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.457 ' H ' ' C ' ' A' ' 73' ' ' LEU . 64.7 t-80 -67.34 154.4 41.42 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.551 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.436 ' N ' ' ND1' ' A' ' 75' ' ' HIS . 46.1 t-80 -158.87 -44.52 0.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.579 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -162.59 -42.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.607 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 84.9 t60 54.19 99.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.579 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -57.73 124.3 18.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.416 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.505 179.893 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.477 ' SD ' ' N ' ' B' ' 1' ' ' MET . 2.2 mpt? . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 38.6 m -67.14 142.53 57.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.331 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -113.84 47.81 1.14 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.633 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.603 HD22 ' N ' ' B' ' 4' ' ' LEU . 3.6 mm? 50.98 -104.29 0.16 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.641 179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . . . . . . . . . 53.9 t80 63.28 -67.12 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.149 0.5 . . . . 0.0 110.45 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . 0.536 ' N ' ' O ' ' B' ' 4' ' ' LEU . 1.3 m -60.6 113.75 2.62 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.482 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.645 ' N ' ' HD2' ' B' ' 8' ' ' PRO . 67.1 t -55.37 -49.86 90.07 Favored Pre-proline 0 CA--C 1.537 0.475 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.826 178.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.645 ' HD2' ' N ' ' B' ' 7' ' ' VAL . 6.7 Cg_endo -46.7 -20.6 1.1 Allowed 'Trans proline' 0 C--N 1.305 -1.716 0 C-N-CA 121.831 1.687 . . . . 0.0 112.296 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -60.17 -42.54 95.19 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.151 0.501 . . . . 0.0 110.489 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . 0.456 ' CD2' ' OH ' ' B' ' 33' ' ' TYR . 1.5 m-85 -58.52 -41.97 86.64 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.407 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 64.6 mt -67.65 -44.23 86.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-O 121.533 0.682 . . . . 0.0 110.464 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -51.61 -30.61 21.84 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.629 -179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -69.53 -32.05 70.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.115 0.483 . . . . 0.0 110.408 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.5 mt -71.67 -39.35 70.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.293 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -55.85 -32.1 63.33 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.095 -179.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -69.25 -30.61 68.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.522 179.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -67.87 -50.54 55.86 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.796 -0.361 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 12.3 pt -72.73 -35.86 51.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.098 0.475 . . . . 0.0 110.773 179.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -70.94 -54.34 11.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.43 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.417 ' O ' ' CB ' ' B' ' 21' ' ' ASN . 28.8 ttp -99.03 -62.5 1.23 Allowed 'General case' 0 N--CA 1.47 0.525 0 CA-C-O 120.971 0.415 . . . . 0.0 110.407 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.441 HD21 ' HA ' ' B' ' 25' ' ' ASP . 11.1 t-20 78.6 49.81 0.03 OUTLIER 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.244 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tm0? -51.06 -41.34 59.85 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-O 121.264 0.554 . . . . 0.0 110.844 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 31.4 t -165.44 65.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.235 -179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -154.43 -131.97 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 121.179 0.514 . . . . 0.0 110.405 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . 0.441 ' HA ' HD21 ' B' ' 21' ' ' ASN . 69.1 m-20 -151.93 -175.59 5.29 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.46 0.648 . . . . 0.0 109.996 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -80.02 -104.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.95 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.641 HD11 ' HD2' ' B' ' 67' ' ' LYS . 15.8 tt -63.11 -37.12 78.57 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.243 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 76.5 m80 -63.13 -3.52 1.82 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.477 -179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -57.54 -46.52 83.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.407 179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.574 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -63.96 -43.17 96.59 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.176 179.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.574 ' N ' ' SD ' ' B' ' 30' ' ' MET . 22.5 t-20 -52.48 -53.65 42.91 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.769 -178.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 8.3 t -64.22 -53.51 48.11 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.823 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.456 ' OH ' ' CD2' ' B' ' 10' ' ' PHE . 45.0 t80 -59.22 -49.44 77.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.532 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.459 ' N ' ' O ' ' B' ' 30' ' ' MET . 42.3 t80 -56.92 -47.24 81.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.821 -179.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 71.1 ttp85 -65.06 -31.35 72.53 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 121.025 0.44 . . . . 0.0 110.507 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.4 t -68.8 -42.85 76.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.646 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.11 -63.68 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.764 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.556 HG23 ' N ' ' B' ' 39' ' ' SER . 26.7 m -48.83 -44.46 15.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.41 -179.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . 0.556 ' N ' HG23 ' B' ' 38' ' ' VAL . 62.9 p -60.7 -40.23 91.49 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.412 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 96.7 m -69.4 -46.76 66.1 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.121 0.486 . . . . 0.0 110.677 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.402 ' O ' ' O ' ' B' ' 44' ' ' ASP . 93.3 mt -60.35 -30.06 69.3 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.409 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 84.9 t -89.16 -39.69 12.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.154 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -69.38 -13.66 62.49 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' B' ' 45' ' ' GLN . 71.8 m-20 -146.45 166.74 25.51 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.346 0.593 . . . . 0.0 109.564 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.458 ' HB3' ' O ' ' B' ' 44' ' ' ASP . 15.5 tt0 79.22 -77.99 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.71 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 24.6 mt 41.11 37.88 0.64 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.017 179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 13.1 t -72.34 -32.22 66.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.643 -179.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.421 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.6 tttt -170.41 132.2 0.98 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.611 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -51.23 -40.67 59.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.786 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.421 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -62.9 -44.49 95.97 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.824 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 19.8 t -57.46 -44.91 85.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.569 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.462 HG23 ' N ' ' B' ' 53' ' ' LEU . 28.5 m -79.22 -44.96 24.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.246 0.546 . . . . 0.0 110.683 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.462 ' N ' HG23 ' B' ' 52' ' ' VAL . 58.4 tp -57.06 -57.02 14.39 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.823 -178.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.473 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 0.2 OUTLIER -50.9 -34.59 29.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.257 0.551 . . . . 0.0 110.502 -179.309 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 49.9 mtt85 -71.81 -41.87 67.74 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.978 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.3 -53.42 46.07 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.632 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.523 -179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -58.19 -37.8 75.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.473 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 4.4 m-70 -73.41 -38.95 65.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.38 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 40.7 tp -55.64 -30.11 60.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.567 -179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -52.33 -28.28 18.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -59.62 -32.27 70.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.571 179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.88 -55.61 7.2 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.521 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -51.68 -42.67 62.32 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.265 0.555 . . . . 0.0 110.397 -179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -63.92 -39.65 94.67 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.415 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . . . . . . . . . 20.2 mmtp -62.84 -38.25 90.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.468 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 70.8 t -62.14 -47.93 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 CA-C-O 121.243 0.544 . . . . 0.0 110.509 -179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' B' ' 27' ' ' ILE . 0.0 OUTLIER -66.04 -40.79 91.26 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 122.014 0.911 . . . . 0.0 111.296 -179.278 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -49.8 -25.79 3.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.312 -179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . -85.84 -20.38 55.93 Favored Glycine 0 CA--C 1.52 0.388 0 N-CA-C 110.888 -0.885 . . . . 0.0 110.888 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.441 ' N ' ' O ' ' B' ' 67' ' ' LYS . 55.4 mm-40 -91.22 -139.63 0.16 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.956 0.408 . . . . 0.0 110.057 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.18 -62.35 0.41 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.488 0.661 . . . . 0.0 110.562 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.436 ' N ' ' O ' ' B' ' 70' ' ' GLU . 67.6 mttm 61.87 29.89 18.02 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.486 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' B' ' 73' ' ' LEU . 4.1 mm? -84.77 -50.39 7.63 Favored 'General case' 0 CA--C 1.504 -0.826 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.967 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . 0.405 ' C ' ' O ' ' B' ' 73' ' ' LEU . 27.2 mt-10 -34.65 -49.41 0.41 Allowed 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.797 0.808 . . . . 0.0 110.903 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.547 ' CG ' ' H ' ' B' ' 76' ' ' HIS . 51.1 t60 -126.42 -118.89 0.26 Allowed 'General case' 0 N--CA 1.472 0.652 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.801 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.547 ' H ' ' CG ' ' B' ' 75' ' ' HIS . 58.4 t-80 -158.93 -50.75 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.428 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 67.2 m80 52.01 84.36 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.519 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . 0.443 ' O ' ' CG ' ' B' ' 79' ' ' HIS . 80.6 m80 -56.27 -78.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.474 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . 0.443 ' CG ' ' O ' ' B' ' 78' ' ' HIS . 96.8 m-70 -155.3 157.25 36.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.593 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.356 179.929 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.6 mtt . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.5 t 51.53 55.55 9.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.618 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -65.86 -166.46 0.03 OUTLIER 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.62 -179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tt -163.38 99.97 0.93 Allowed 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.132 0.491 . . . . 0.0 110.578 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -102.07 83.51 2.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.346 179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 30.9 p 43.68 -161.44 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.64 179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.569 ' O ' ' N ' ' A' ' 9' ' ' TYR . 2.6 t -53.69 -55.21 37.77 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.043 178.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.51 ' HD2' ' N ' ' A' ' 7' ' ' VAL . 77.6 Cg_exo -34.94 -25.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.766 0 C-N-CA 122.391 2.06 . . . . 0.0 112.933 -179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.569 ' N ' ' O ' ' A' ' 7' ' ' VAL . 82.9 t80 -56.37 -40.16 74.09 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.281 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -61.82 -45.66 92.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.563 179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 89.5 mt -64.11 -43.68 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.427 0.632 . . . . 0.0 110.552 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -48.63 -23.74 1.12 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.397 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -74.18 -35.33 63.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.172 0.511 . . . . 0.0 110.632 179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 35.1 mt -68.28 -39.41 82.15 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.574 -179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 43.1 mtmt -57.88 -40.09 79.43 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.595 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -65.95 -31.04 71.72 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 120.935 -0.306 . . . . 0.0 110.444 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -67.15 -52.39 42.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.093 0.473 . . . . 0.0 110.97 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.401 HG13 ' N ' ' A' ' 19' ' ' GLU . 11.8 pt -72.82 -42.86 61.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.576 179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.401 ' N ' HG13 ' A' ' 18' ' ' ILE . 52.1 tp10 -62.07 -54.41 41.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.432 -179.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 44.1 mtt -99.34 -139.0 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -170.3 49.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.232 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -58.12 -45.52 87.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.494 -179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.3 m 174.5 72.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.325 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -163.76 -136.77 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 121.115 0.483 . . . . 0.0 110.301 179.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -145.18 -160.19 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.307 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.7 tttm -96.18 -108.83 0.15 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.357 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.599 ' O ' ' SD ' ' A' ' 30' ' ' MET . 10.3 tp -55.85 -36.75 44.81 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.01 0.433 . . . . 0.0 110.52 -179.276 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.402 ' N ' HG23 ' A' ' 27' ' ' ILE . 97.3 m-70 -81.42 20.51 0.87 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.526 -179.681 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.72 -52.8 26.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.128 0.49 . . . . 0.0 110.754 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.599 ' SD ' ' O ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.88 -32.92 72.34 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.249 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.517 ' N ' ' SD ' ' A' ' 30' ' ' MET . 51.3 t30 -51.68 -48.79 63.32 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 120.447 -0.501 . . . . 0.0 110.472 -178.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.6 t -67.9 -52.88 31.27 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.744 179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -60.67 -48.06 83.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.325 0.583 . . . . 0.0 110.936 -179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.576 ' CE1' HG21 ' A' ' 38' ' ' VAL . 54.4 t80 -55.18 -54.81 38.64 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.997 -179.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.34 -35.63 76.1 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.438 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 37.5 t -63.04 -44.64 95.33 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.392 -179.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 41.9 t -68.83 -56.6 11.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 120.212 -0.595 . . . . 0.0 110.5 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.576 HG21 ' CE1' ' A' ' 34' ' ' TYR . 90.5 t -54.79 -49.09 71.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.36 -178.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.0 p -60.34 -45.22 94.21 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.631 -0.428 . . . . 0.0 110.307 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 78.3 m -61.13 -48.78 80.03 Favored 'General case' 0 C--N 1.328 -0.37 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.544 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.8 mt -65.86 -41.27 91.87 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.15 0.5 . . . . 0.0 110.743 -179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 42' ' ' VAL . 60.2 t -86.16 26.62 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.23 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -162.32 10.45 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -151.15 17.98 0.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.186 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -147.79 -79.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.669 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.9 mt 48.46 45.75 20.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.856 -179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 12.6 t -85.61 -27.15 25.64 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.465 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.7 tptm -173.02 132.93 0.52 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.975 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.44 ' O ' ' CB ' ' A' ' 53' ' ' LEU . 8.5 m120 -51.19 -45.79 61.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.513 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.6 -46.79 88.92 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.968 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 37.4 t -56.32 -46.3 81.65 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.269 -0.573 . . . . 0.0 111.084 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.573 HG23 ' N ' ' A' ' 53' ' ' LEU . 34.3 m -78.48 -49.92 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.425 0 CA-C-O 121.736 0.779 . . . . 0.0 110.333 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.6 ' C ' HD23 ' A' ' 53' ' ' LEU . 9.0 tt -52.77 -59.97 3.83 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.937 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -49.22 -34.77 15.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.342 0.592 . . . . 0.0 110.196 -179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -65.2 -38.77 91.5 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.962 -179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 52' ' ' VAL . 16.3 mm -65.52 -51.03 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 C-N-CA 120.361 -0.535 . . . . 0.0 110.449 -178.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -58.85 -40.7 85.06 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.506 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.4 ' ND1' ' N ' ' A' ' 59' ' ' LEU . 0.2 OUTLIER -72.62 -47.63 46.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.144 179.7 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.4 ' N ' ' ND1' ' A' ' 58' ' ' HIS . 37.6 tp -55.89 -33.69 64.83 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 121.051 0.453 . . . . 0.0 110.436 -178.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -56.76 -34.7 67.83 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.151 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.509 ' O ' ' ND2' ' A' ' 64' ' ' ASN . 4.7 pt-20 -52.84 -30.49 33.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.335 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.82 -42.0 35.22 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.553 0.692 . . . . 0.0 110.909 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.517 ' CD1' ' N ' ' A' ' 64' ' ' ASN . 0.1 OUTLIER -56.17 -47.49 78.15 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.163 -179.471 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.517 ' N ' ' CD1' ' A' ' 63' ' ' TYR . 0.7 OUTLIER -73.4 -22.59 60.21 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-O 121.003 0.43 . . . . 0.0 110.199 -179.246 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.22 -47.53 70.57 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 121.619 0.723 . . . . 0.0 111.348 -179.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.456 HG12 ' O ' ' A' ' 63' ' ' TYR . 0.8 OUTLIER -56.77 -40.79 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.12 -179.127 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.429 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 21.1 mtmt -67.86 -45.89 73.27 Favored 'General case' 0 CA--C 1.509 -0.628 0 CA-C-O 122.015 0.912 . . . . 0.0 111.127 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -55.66 -32.24 63.06 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.963 179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -80.83 -14.28 79.9 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -97.83 -168.94 1.75 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.42 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 60.6 p -163.84 127.64 2.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.543 -179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -155.5 108.39 2.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.462 179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -69.44 70.11 0.26 Allowed 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.723 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -58.94 -101.03 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.64 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -163.44 149.13 11.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.568 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 52.66 98.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.626 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 47.8 p-80 -65.61 138.13 57.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.572 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 74.9 m80 -60.02 -49.04 79.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.511 -179.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -168.9 130.71 1.23 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.464 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 86.2 t60 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.373 179.939 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mtt . . . . . 0 N--CA 1.489 1.518 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . 0.437 ' O ' ' O ' ' B' ' 3' ' ' GLU . 15.4 p -165.48 -24.76 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.559 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' B' ' 5' ' ' PHE . 80.6 mm-40 56.52 158.05 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.489 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 57.2 mt 56.76 6.89 0.34 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.633 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' PHE . . . . . 0.45 ' H ' ' C ' ' B' ' 3' ' ' GLU . 54.1 p90 -70.06 -34.45 73.22 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.344 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -78.35 132.32 37.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.312 0.577 . . . . 0.0 109.793 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.589 ' N ' ' CD ' ' B' ' 8' ' ' PRO . 2.2 t -67.01 -39.86 24.95 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.135 178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.589 ' CD ' ' N ' ' B' ' 7' ' ' VAL . 76.7 Cg_exo -50.42 -26.75 16.82 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.89 1.727 . . . . 0.0 112.154 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -60.6 -40.76 92.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.426 0.631 . . . . 0.0 110.517 -179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -58.76 -41.78 87.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.487 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ILE . . . . . . . . . . . . . 56.2 mt -67.44 -44.45 86.86 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 CA-C-O 121.292 0.568 . . . . 0.0 110.267 -179.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . 88.3 mt-10 -49.18 -27.67 3.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.59 -179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 61.6 t-20 -74.23 -35.11 63.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 179.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' B' ' 33' ' ' TYR . 40.7 mt -70.05 -38.69 75.88 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.593 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -57.29 -40.17 77.22 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.09 -179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -65.8 -35.91 82.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.282 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . 0.439 ' O ' ' OD1' ' B' ' 21' ' ' ASN . 7.5 m-70 -65.96 -48.74 70.32 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 120.561 -0.455 . . . . 0.0 110.742 -179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -74.77 -33.12 30.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.171 0.51 . . . . 0.0 110.694 179.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -75.19 -56.61 4.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.073 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' MET . . . . . 0.436 ' C ' ' ND2' ' B' ' 21' ' ' ASN . 47.6 mtt -87.28 -56.27 3.44 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.998 0.428 . . . . 0.0 110.617 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . 0.439 ' OD1' ' O ' ' B' ' 17' ' ' HIS . 3.7 m-80 73.58 46.19 0.22 Allowed 'General case' 0 CA--C 1.501 -0.929 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.026 179.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -39.95 -64.54 0.48 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 121.127 0.489 . . . . 0.0 111.02 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 13.8 t -140.62 3.44 1.88 Allowed 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.768 179.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -86.99 -131.85 0.06 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.125 0.488 . . . . 0.0 110.335 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -156.43 -158.13 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.336 -179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -95.47 -101.87 0.16 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.514 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' ILE . . . . . 0.401 HD11 ' OE1' ' B' ' 70' ' ' GLU . 44.3 mm -62.64 -37.26 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.43 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' HIS . . . . . . . . . . . . . 78.1 m80 -69.89 2.55 3.34 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.536 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.74 -50.36 36.89 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.038 0.447 . . . . 0.0 111.087 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.562 ' SD ' ' N ' ' B' ' 31' ' ' ASN . 0.0 OUTLIER -62.11 -42.61 99.4 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.995 179.461 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.562 ' N ' ' SD ' ' B' ' 30' ' ' MET . 44.9 t30 -50.6 -51.52 47.76 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.523 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 70.3 p -63.63 -51.56 64.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.587 -0.445 . . . . 0.0 110.591 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.465 ' O ' ' CD1' ' B' ' 33' ' ' TYR . 43.2 t80 -65.09 -20.4 66.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.618 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' TYR . . . . . 0.675 ' O ' HG23 ' B' ' 38' ' ' VAL . 52.9 t80 -72.97 -53.87 10.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.062 -179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.494 ' NH1' ' CZ ' ' A' ' 34' ' ' TYR . 19.7 mmm180 -72.51 -18.32 61.66 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.821 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 32.0 t -68.92 -51.64 37.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.947 -179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.527 HG23 ' N ' ' B' ' 38' ' ' VAL . 10.2 m -77.4 -44.72 30.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.515 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.675 HG23 ' O ' ' B' ' 34' ' ' TYR . 71.0 t -53.71 -49.45 57.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.382 -179.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' SER . . . . . . . . . . . . . 36.8 t -64.44 -25.74 68.14 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 120.864 0.364 . . . . 0.0 110.348 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' THR . . . . . 0.546 ' O ' ' N ' ' B' ' 44' ' ' ASP . 35.5 m -83.13 -50.52 8.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.554 179.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.561 HD22 ' CZ ' ' B' ' 55' ' ' ARG . 96.8 mt -63.02 -42.24 99.75 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.921 0.391 . . . . 0.0 110.827 -179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 69.5 t -68.47 -17.7 22.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.415 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -108.0 -19.25 13.57 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.048 0.451 . . . . 0.0 110.794 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.546 ' N ' ' O ' ' B' ' 40' ' ' THR . 37.6 t70 -90.5 -25.54 20.22 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.394 -179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -117.62 160.56 21.08 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.308 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -168.74 31.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.9 179.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 69.1 m -67.09 -41.19 86.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 121.354 0.597 . . . . 0.0 110.902 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.487 ' HG2' ' H ' ' B' ' 50' ' ' ALA . 87.2 tttt -174.08 142.93 0.88 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.265 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -51.49 -34.85 37.58 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.741 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . 0.487 ' H ' ' HG2' ' B' ' 48' ' ' LYS . . . -75.51 -50.97 14.08 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.334 -0.546 . . . . 0.0 110.858 179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -50.67 -43.23 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.698 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' VAL . . . . . 0.422 HG23 ' N ' ' B' ' 53' ' ' LEU . 23.0 m -75.15 -38.01 41.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 121.07 0.462 . . . . 0.0 110.285 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' LEU . . . . . 0.422 ' N ' HG23 ' B' ' 52' ' ' VAL . 65.7 tp -57.97 -36.27 72.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.573 -179.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' LYS . . . . . 0.417 ' O ' ' CG ' ' B' ' 58' ' ' HIS . 57.6 mtpt -57.33 -41.57 80.23 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.549 -179.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.561 ' CZ ' HD22 ' B' ' 41' ' ' LEU . 67.6 mtp180 -65.63 -41.36 92.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.117 0.484 . . . . 0.0 110.449 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 21.9 mm -65.33 -50.5 72.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.856 -179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' GLN . . . . . 0.637 HE22 ' CG1' ' A' ' 42' ' ' VAL . 92.4 mm-40 -57.53 -39.42 76.56 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.311 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' HIS . . . . . 0.417 ' CG ' ' O ' ' B' ' 54' ' ' LYS . 52.8 m170 -65.85 -44.97 83.86 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.161 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 36.7 tp -53.57 -27.78 28.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.099 0.476 . . . . 0.0 111.016 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -52.52 -36.7 55.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.94 -179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.78 -31.66 71.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.477 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.98 -58.88 4.09 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.124 0.488 . . . . 0.0 110.813 -178.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -40.19 61.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.353 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -66.66 -39.06 88.03 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.595 0.712 . . . . 0.0 110.319 -178.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' LYS . . . . . 0.467 ' O ' ' N ' ' B' ' 69' ' ' GLY . 18.7 mmtp -62.67 -36.8 84.06 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.305 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.4 ' O ' ' CG ' ' B' ' 70' ' ' GLU . 82.2 t -63.8 -42.15 94.95 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.749 0 CA-C-O 121.378 0.608 . . . . 0.0 110.264 -179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -67.18 -45.12 77.92 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 121.693 0.759 . . . . 0.0 111.488 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 51.7 ttt85 -88.71 1.49 55.04 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.103 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' B' ' 65' ' ' LYS . . . -108.67 -34.37 2.65 Favored Glycine 0 N--CA 1.474 1.226 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.473 ' HG3' ' H ' ' B' ' 71' ' ' SER . 1.5 pp20? -66.93 -55.41 14.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.87 0.367 . . . . 0.0 110.549 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' SER . . . . . 0.473 ' H ' ' HG3' ' B' ' 70' ' ' GLU . 93.0 p 43.09 -165.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.621 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -146.51 -17.64 0.43 Allowed 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.427 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 4.3 tt -84.36 127.35 33.94 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.219 0.533 . . . . 0.0 110.529 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -118.01 -114.49 0.33 Allowed 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.553 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.575 ' NE2' ' NE2' ' B' ' 76' ' ' HIS . 79.4 t60 -155.49 -109.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.404 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' HIS . . . . . 0.575 ' NE2' ' NE2' ' B' ' 75' ' ' HIS . 6.2 m-70 -85.46 142.68 29.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.154 0.502 . . . . 0.0 110.406 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -59.38 -77.47 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.453 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' HIS . . . . . . . . . . . . . 23.4 m-70 53.05 177.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.551 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -64.25 -45.46 88.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.588 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' HIS . . . . . . . . . . . . . 14.9 p80 . . . . . 0 C--O 1.222 -0.393 0 CA-C-O 117.928 -1.034 . . . . 0.0 110.451 -179.978 . . . . . . . . 0 0 . 1 stop_ save_