data_2jqo_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 2jqo _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 ' 13' ' ' MET . . . . . . . . . . . . . 82.6 mtp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -83.73 115.16 22.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.029 0.442 . . . . 0.0 109.988 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.0 p -97.44 130.47 44.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.251 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.417 HD13 ' N ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -130.27 130.14 44.17 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.417 ' N ' HD13 ' A' ' 16' ' ' LEU . 50.8 t -95.54 123.51 47.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.22 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 176.61 27.29 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.706 -177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -101.24 134.84 43.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.66 0.267 . . . . 0.0 110.734 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 t -87.27 109.47 19.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.85 -36.76 4.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.103 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.716 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 89.6 mt -133.32 141.58 48.03 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -141.42 130.92 23.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.096 0.474 . . . . 0.0 111.624 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -115.83 -146.44 0.4 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 170.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -100.65 -55.73 2.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.029 0.377 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -90.46 -6.74 54.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.578 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -151.1 155.03 38.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.053 0.454 . . . . 0.0 111.437 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.463 ' HB3' HD11 ' A' ' 62' ' ' LEU . . . -141.72 149.5 40.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.085 176.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.716 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 70.4 mt -105.21 116.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.866 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 mt -118.78 151.91 37.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.282 0.563 . . . . 0.0 111.71 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -101.68 116.66 45.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.937 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.5 p -84.9 0.12 52.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.982 0.42 . . . . 0.0 111.301 -176.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 34' ' ' THR . 10.6 t70 -95.69 -172.22 2.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.496 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.418 ' H ' ' CG ' ' A' ' 33' ' ' ASP . 38.4 p -106.16 -2.29 22.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -174.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -86.27 124.19 32.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.841 0.353 . . . . 0.0 110.367 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 145.65 34.45 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.812 176.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.29 165.99 26.84 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.707 2.271 . . . . 0.0 112.44 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.4 176.61 37.09 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.19 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -51.62 -47.64 63.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 122.539 0.336 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.2 mt-10 -71.75 -26.24 62.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.532 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -67.1 -34.0 76.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.89 0.376 . . . . 0.0 110.201 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -74.27 -10.1 59.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.034 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -106.5 -5.11 19.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.877 0.37 . . . . 0.0 110.661 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 77.9 mt -74.54 163.78 27.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.491 ' HB2' ' HG3' ' A' ' 48' ' ' GLN . 16.3 m -76.18 149.25 37.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 50' ' ' MET . 1.6 mp0 -49.48 -51.17 37.78 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.533 0.521 . . . . 0.0 111.321 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.82 -39.08 94.93 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.623 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.491 ' HG3' ' HB2' ' A' ' 45' ' ' SER . 83.2 mt-30 -64.75 -41.89 95.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.996 0.427 . . . . 0.0 110.291 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.98 -38.88 86.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.602 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.425 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 80.7 mtp -62.32 -40.86 97.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.189 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -72.66 -25.37 61.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 110.875 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -81.57 -54.46 5.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -92.71 23.88 3.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 0.0 110.528 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -50.94 -28.8 10.53 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.518 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -66.27 -31.59 72.5 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -143.57 28.86 1.43 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -173.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.461 HD12 ' CG2' ' A' ' 29' ' ' ILE . 15.1 tt -96.56 134.93 32.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.525 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.498 HG23 ' HG2' ' A' ' 90' ' ' PRO . 79.4 t -132.83 127.26 55.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.868 0.366 . . . . 0.0 110.354 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 63.9 mt -95.05 116.95 37.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 176.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 22.6 m -95.6 142.43 13.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.167 0.508 . . . . 0.0 111.68 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.15 114.39 4.2 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.431 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' A' ' 28' ' ' ALA . 88.3 mt -96.59 9.87 40.22 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 122.61 0.364 . . . . 0.0 110.787 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.7 p -59.9 -31.15 69.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.074 0.464 . . . . 0.0 111.203 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.629 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 2.9 mm-40 -79.19 -19.46 50.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.293 -177.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.3 mt -103.55 113.37 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.584 -175.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -102.15 31.95 3.72 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.758 0.789 . . . . 0.0 110.618 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -145.3 37.72 1.13 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.3 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.453 HG23 ' HB3' ' A' ' 62' ' ' LEU . 40.7 p -69.86 5.01 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.04 -15.58 58.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.631 0.253 . . . . 0.0 111.287 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -89.3 -4.67 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.08 0.466 . . . . 0.0 109.944 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 tp -81.68 116.49 21.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.979 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -99.51 130.4 45.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.727 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.4 ptt85 -90.23 142.47 27.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.8 19.06 45.2 Favored Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 -171.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.416 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 6.1 mm-40 -134.67 -167.97 2.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.595 -171.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 88.3 tttt -127.76 138.77 52.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.924 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.493 HG23 HD12 ' A' ' 99' ' ' LEU . 38.3 pt -139.81 168.03 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 121.505 0.669 . . . . 0.0 112.233 -178.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -123.93 106.88 10.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.829 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.612 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.0 m -101.6 147.51 8.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -173.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.576 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 6.0 m-90 -110.22 115.4 29.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.815 173.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.471 ' HB3' HG22 ' A' ' 94' ' ' ILE . 44.2 p90 -127.94 172.34 10.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 0.0 111.008 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -155.95 -50.02 0.08 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.995 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 m -84.83 119.89 25.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.542 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 84' ' ' ARG . 13.9 ptt180 -139.13 153.03 47.92 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.938 0.399 . . . . 0.0 111.045 -176.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -120.64 106.43 11.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.71 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -86.96 97.94 10.98 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.14 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.8 m -112.27 -14.16 13.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.856 -175.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 60.73 93.59 0.06 OUTLIER Pre-proline 0 N--CA 1.467 0.411 0 O-C-N 123.479 0.487 . . . . 0.0 110.71 -172.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.415 ' HB3' HG23 ' A' ' 57' ' ' ILE . 14.7 Cg_exo -69.87 146.95 83.82 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.797 -1.335 . . . . 0.0 112.299 -1.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.498 ' HG2' HG23 ' A' ' 58' ' ' VAL . 62.0 Cg_endo -74.07 155.95 47.38 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.626 2.217 . . . . 0.0 112.783 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.6 p -128.02 145.05 51.11 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.712 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -129.95 128.54 42.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.681 0.277 . . . . 0.0 111.008 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.3 m -87.29 113.71 23.25 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.471 HG22 ' HB3' ' A' ' 81' ' ' PHE . 29.3 pt -108.29 129.44 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.059 0.457 . . . . 0.0 110.7 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.629 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 82.9 mt-30 -101.33 -9.43 21.18 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.664 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 51.6 tttm -158.72 140.98 14.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.3 165.76 26.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.872 0.367 . . . . 0.0 111.047 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -125.11 117.24 23.48 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.493 HD12 HG23 ' A' ' 77' ' ' ILE . 37.1 tp -70.64 137.99 50.37 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.375 -177.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 90.8 mt . . . . . 0 C--N 1.326 -0.442 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 175.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 61.9 mtm . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.603 0.239 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -85.42 120.08 26.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.14 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.9 m -96.44 128.45 43.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.502 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' A' ' 81' ' ' PHE . 11.6 mt -130.21 160.02 35.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.788 173.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -127.57 126.93 68.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.58 166.69 29.19 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.797 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -104.76 132.89 50.46 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.745 0.307 . . . . 0.0 110.285 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.47 HG23 HD12 ' A' ' 71' ' ' LEU . 12.0 t -89.15 100.65 11.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 m -92.12 -40.43 12.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.53 -177.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.786 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 99.0 mt -127.78 141.14 51.66 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.916 -178.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -126.39 136.25 52.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.759 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.679 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 7.7 t70 -135.92 -167.15 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.422 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.4 t-20 -79.49 106.96 11.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -176.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 71.41 7.99 6.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.324 0.65 . . . . 0.0 111.841 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HG3' ' HB3' ' A' ' 24' ' ' ASP . 32.9 ptt180 -146.46 140.21 26.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.798 0.332 . . . . 0.0 110.398 -176.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.489 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -128.65 142.57 50.99 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.435 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.786 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 60.4 mt -97.68 107.07 19.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.15 147.28 26.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.959 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 56' ' ' ASN . 20.0 mt -106.31 123.71 61.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.076 173.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.5 p -81.71 -7.97 59.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.54 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.21 156.22 38.77 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 175.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.2 p -100.04 12.8 36.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -168.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -125.81 144.11 50.78 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 171.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.9 137.82 79.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 173.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.512 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 56.4 Cg_endo -69.99 177.38 5.79 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.474 2.116 . . . . 0.0 112.318 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.19 169.72 54.09 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.531 -0.843 . . . . 0.0 111.753 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -66.31 -27.01 67.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.573 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 37.4 mp0 -62.6 -42.49 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.376 176.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.512 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 14.2 m-20 -67.0 -35.27 79.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.433 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -69.6 -23.48 63.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.91 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.29 -15.37 38.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.423 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.7 mt -71.48 173.11 8.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.459 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.8 m -103.04 177.42 4.84 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.49 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.62 -47.54 81.91 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.073 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -33.15 72.39 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.635 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.477 ' HB3' HD12 ' A' ' 44' ' ' LEU . 78.8 mm-40 -65.07 -51.84 59.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.771 0.32 . . . . 0.0 110.63 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.3 mt -67.6 -31.38 71.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.491 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.625 ' HG3' ' HG3' ' A' ' 89' ' ' PRO . 47.9 ttm -63.01 -33.61 75.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.229 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -87.31 -44.62 11.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.224 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -69.82 -54.47 13.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.358 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.448 ' O ' HG21 ' A' ' 57' ' ' ILE . 99.4 m-85 -99.03 46.09 0.99 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tttp -52.15 -35.4 48.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.768 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -111.67 14.45 21.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.823 0.344 . . . . 0.0 111.425 -177.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' ILE . 18.6 m120 -122.88 -4.52 8.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.811 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.448 HG21 ' O ' ' A' ' 53' ' ' PHE . 13.2 tt -97.47 116.36 39.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.531 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.495 HG23 ' HB2' ' A' ' 90' ' ' PRO . 88.4 t -120.88 116.28 49.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.362 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.533 HG12 HG12 ' A' ' 29' ' ' ILE . 59.9 mt -85.32 104.72 13.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.9 m -93.92 141.29 15.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.167 0.508 . . . . 0.0 111.421 -175.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.37 130.62 9.82 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.589 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.516 ' HB3' HG22 ' A' ' 68' ' ' THR . 41.2 mt -105.61 7.74 32.89 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 124.177 0.575 . . . . 0.0 110.189 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.6 m -59.74 -28.56 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -172.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -95.07 -14.03 24.63 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.559 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 55.9 mt -107.34 104.28 16.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.73 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -77.53 -23.12 50.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.118 -177.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -85.55 41.04 0.87 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.222 0.534 . . . . 0.0 111.089 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.516 HG22 ' HB3' ' A' ' 62' ' ' LEU . 1.8 p -96.07 15.19 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.896 177.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -41.9 93.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.13 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.81 1.73 37.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.17 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.47 HD12 HG23 ' A' ' 20' ' ' VAL . 42.7 tp -77.11 121.18 23.23 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -120.69 -172.46 2.38 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.457 -175.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -98.05 134.56 40.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 88.26 26.39 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -103.5 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.016 0.436 . . . . 0.0 110.51 -176.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -132.14 127.77 36.65 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 176.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.461 HG23 ' HA ' ' A' ' 99' ' ' LEU . 37.4 pt -137.25 155.01 31.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.426 0.631 . . . . 0.0 112.037 -176.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.411 ' HB2' HD13 ' A' ' 100' ' ' LEU . 86.0 tttt -106.95 114.8 29.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.574 173.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 22.6 m -104.56 139.5 25.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 0.0 111.944 -173.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -109.4 122.82 48.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.118 170.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' A' ' 16' ' ' LEU . 2.0 p90 -149.06 177.13 9.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.073 0.463 . . . . 0.0 110.912 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -144.79 -42.01 0.24 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.3 m -82.5 104.76 13.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.163 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -98.76 117.35 33.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -99.2 115.39 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.543 . . . . 0.0 110.523 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.23 90.97 4.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.259 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -98.29 -31.11 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.873 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.83 90.46 0.08 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 124.015 0.822 . . . . 0.0 110.715 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.625 ' HG3' ' HG3' ' A' ' 50' ' ' MET . 36.7 Cg_endo -62.37 151.4 63.99 Favored 'Cis proline' 0 C--N 1.354 0.842 0 C-N-CA 124.762 -0.932 . . . . 0.0 114.16 7.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.495 ' HB2' HG23 ' A' ' 58' ' ' VAL . 51.6 Cg_exo -54.35 144.03 62.81 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.602 2.868 . . . . 0.0 113.911 -174.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.1 t -130.48 164.31 25.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.579 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.25 170.43 22.28 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.697 0.284 . . . . 0.0 110.484 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -126.66 117.32 22.51 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 27.0 pt -89.46 141.82 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.439 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -95.46 -35.07 11.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.908 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -158.75 149.19 19.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.398 175.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.476 ' OH ' ' HA ' ' A' ' 68' ' ' THR . 13.2 p90 -138.93 143.71 38.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.257 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -114.68 129.41 56.68 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.359 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.461 ' HA ' HG23 ' A' ' 77' ' ' ILE . 57.3 tp -76.17 122.47 24.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.621 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 78' ' ' LYS . 87.3 mt . . . . . 0 C--N 1.324 -0.539 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.529 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 65.8 mtm . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -85.43 116.74 23.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 110.17 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.4 m -84.9 125.63 32.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.227 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.449 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 3.0 tm? -116.67 120.2 37.88 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.5 t -98.51 123.71 51.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.143 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.36 169.59 34.37 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.854 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -105.55 140.9 37.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.246 0.218 . . . . 0.0 110.52 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.478 HG22 HD11 ' A' ' 71' ' ' LEU . 22.6 t -87.76 113.92 25.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.64 -41.33 4.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.192 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.678 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 95.7 mt -134.02 160.17 38.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.814 0.34 . . . . 0.0 110.416 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -148.43 162.3 39.87 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.826 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -156.68 -164.68 1.7 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -75.81 -47.74 24.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 111.336 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -82.37 -45.89 14.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.861 -176.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.657 ' HG2' ' HA2' ' A' ' 61' ' ' GLY . 33.1 mtm180 -138.71 163.3 32.5 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.569 -169.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.404 ' HB2' HD13 ' A' ' 62' ' ' LEU . . . -116.12 152.49 33.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.314 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.678 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 58.6 mt -109.32 113.99 45.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.075 0.464 . . . . 0.0 110.787 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.451 HD11 HD12 ' A' ' 77' ' ' ILE . 66.9 mt -113.78 144.16 43.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.934 -176.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.3 mt -102.9 120.66 53.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -85.26 -7.58 58.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.095 0.474 . . . . 0.0 111.1 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.498 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 10.2 t70 -89.79 158.93 17.28 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.645 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.7 p -97.6 2.6 50.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -81.82 110.37 17.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 173.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.49 131.84 70.56 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.206 -175.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.35 160.39 47.94 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.845 2.363 . . . . 0.0 112.032 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.54 179.58 35.99 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.144 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.473 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 7.9 tmtm? -57.94 -41.42 82.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.851 0.358 . . . . 0.0 110.542 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.03 -27.51 64.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.235 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.08 -33.93 76.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.93 0.395 . . . . 0.0 109.967 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.45 -14.23 61.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -89.29 -22.18 22.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.009 0.433 . . . . 0.0 109.956 175.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -69.73 153.07 43.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.665 178.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.9 p -82.93 165.66 19.54 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.151 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.523 ' O ' ' HG3' ' A' ' 50' ' ' MET . 36.2 mp0 -48.72 -50.98 31.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.709 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.13 -48.99 83.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.748 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -64.02 -32.26 73.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.636 0.255 . . . . 0.0 111.142 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.8 tp -67.34 -41.85 84.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 65.0 mtt -65.7 -32.01 73.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -66.43 -36.03 81.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.867 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -82.81 -54.49 5.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.135 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.32 41.34 1.06 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.343 0.592 . . . . 0.0 110.238 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 77.9 tttt -60.79 124.99 22.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.607 -177.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 4.5 m-20 72.99 4.86 5.08 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.917 0.761 . . . . 0.0 111.256 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.498 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 13.6 m120 -118.63 11.91 12.96 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.491 HD13 ' HG2' ' A' ' 50' ' ' MET . 13.2 tt -129.06 134.2 64.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.196 -176.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 82.1 t -124.38 132.72 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.459 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 91' ' ' SER . 29.8 mt -98.94 104.9 16.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.645 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 21.9 m -94.21 128.87 45.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.32 0.581 . . . . 0.0 111.297 -176.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.657 ' HA2' ' HG2' ' A' ' 27' ' ' ARG . . . -80.33 122.06 5.63 Favored Glycine 0 N--CA 1.443 -0.893 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.669 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.755 HD11 ' HG1' ' A' ' 68' ' ' THR . 80.7 mt -88.43 31.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.131 0.491 . . . . 0.0 110.061 -178.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.4 m -63.69 -26.17 68.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.632 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -105.26 -3.08 23.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.401 0.619 . . . . 0.0 110.081 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.7 mm -122.62 91.05 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.997 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -98.21 18.09 17.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 122.08 0.943 . . . . 0.0 109.913 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -121.15 14.39 11.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.493 -173.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.755 ' HG1' HD11 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -79.8 32.52 0.26 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -171.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -89.49 -14.66 34.8 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.363 0.601 . . . . 0.0 109.717 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -81.8 -28.52 33.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.451 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.478 HD11 HG22 ' A' ' 20' ' ' VAL . 12.6 tp -57.36 123.29 14.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.806 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -104.73 170.74 7.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 111.165 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.8 mtt85 -87.22 143.3 27.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.24 -0.437 . . . . 0.0 109.979 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.58 42.0 18.74 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -124.28 -174.88 3.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.221 0.534 . . . . 0.0 112.017 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.7 tttm -135.2 125.2 25.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.712 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.541 HG23 ' HA ' ' A' ' 99' ' ' LEU . 2.6 pp -135.6 171.47 17.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.488 0.661 . . . . 0.0 112.708 -174.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -135.15 111.73 9.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.697 174.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.521 HG13 HD13 ' A' ' 77' ' ' ILE . 27.8 m -107.29 156.02 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.816 0.341 . . . . 0.0 111.208 -176.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.529 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 9.8 m-90 -122.69 130.59 53.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.838 175.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.534 ' HB3' ' HA ' ' A' ' 94' ' ' ILE . 44.5 p90 -148.33 -178.34 6.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.034 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -140.99 -45.06 0.39 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.02 175.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.3 m -82.94 117.76 23.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 49.9 ptt85 -139.61 155.04 47.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.758 0.313 . . . . 0.0 110.58 176.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -122.34 128.98 51.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.372 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.52 59.49 4.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.42 0.628 . . . . 0.0 110.139 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -79.12 -22.27 45.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.697 177.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.456 HD21 ' N ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER 68.69 102.06 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.811 179.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 16.3 Cg_exo -69.0 146.8 81.63 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.829 -1.321 . . . . 0.0 112.194 -0.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 29.9 Cg_exo -61.26 137.56 71.5 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.837 2.358 . . . . 0.0 112.624 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 14.6 m -115.93 145.97 42.47 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.146 176.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -147.41 128.95 15.02 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.588 -176.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 46.7 m -83.41 112.77 20.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.534 ' HA ' ' HB3' ' A' ' 81' ' ' PHE . 40.9 pt -87.04 149.85 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.105 0.479 . . . . 0.0 111.287 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -103.65 -48.09 4.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.32 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -138.48 163.97 30.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.05 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.418 ' CB ' HG11 ' A' ' 79' ' ' VAL . 6.2 p90 -164.23 159.06 19.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.665 0.269 . . . . 0.0 110.725 177.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -121.01 132.75 55.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.711 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.541 ' HA ' HG23 ' A' ' 77' ' ' ILE . 38.4 tp -82.1 108.98 16.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.963 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.8 mt . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.406 0.622 . . . . 0.0 109.858 -179.093 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.432 ' SD ' ' HD2' ' A' ' 96' ' ' LYS . 83.2 mtp . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -83.26 121.81 27.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.762 0.315 . . . . 0.0 110.4 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 m -82.74 125.36 31.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.074 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.488 ' O ' HG21 ' A' ' 79' ' ' VAL . 2.7 tm? -138.72 120.59 15.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -89.97 139.16 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -149.61 145.5 13.75 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.18 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.868 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 87.5 m-85 -91.61 121.14 33.01 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.418 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 40.0 t -75.82 93.57 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.48 -38.13 7.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.094 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.772 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 93.2 mt -121.91 124.75 44.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.155 0.503 . . . . 0.0 110.19 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -124.61 119.05 27.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.936 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -118.47 13.61 13.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.121 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 75.08 -55.08 0.65 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.922 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -85.24 -36.77 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 27' ' ' ARG . 43.1 mtp180 -113.39 148.36 35.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.759 176.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.481 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -138.69 130.81 28.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.02 0.438 . . . . 0.0 110.62 175.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.772 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 66.8 mt -104.34 115.78 46.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.4 mt -114.47 147.18 39.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.125 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.89 129.12 53.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 168.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.5 p -53.93 -58.61 6.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.77 0.319 . . . . 0.0 111.005 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.868 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 35.4 t70 -164.71 140.4 5.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.52 0.676 . . . . 0.0 111.952 174.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.3 m -146.97 17.11 1.23 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm 48.25 64.02 1.83 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.975 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 61.58 96.43 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.994 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -62.73 167.73 11.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.774 2.316 . . . . 0.0 111.998 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -92.18 167.0 30.01 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.978 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -62.97 -28.97 70.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.224 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 39.4 tt0 -66.06 -33.58 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.547 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.86 -34.03 73.05 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -73.87 -19.24 60.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.868 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -78.69 -30.92 46.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.357 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.8 mt -63.3 142.91 58.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.351 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.2 m -76.0 168.91 19.17 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.404 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.53 -49.55 45.62 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.495 0.497 . . . . 0.0 111.537 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.6 -45.62 95.99 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.22 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.73 -41.49 92.18 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.969 0.414 . . . . 0.0 110.675 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.13 -43.52 98.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.165 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 45.9 ttm -67.21 -34.35 77.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.342 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -71.7 -24.65 61.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.709 0.29 . . . . 0.0 111.245 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.88 -54.84 3.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.951 0.405 . . . . 0.0 110.777 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -97.4 40.17 1.17 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.639 -177.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -54.84 -34.99 63.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.417 -173.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -92.37 -5.34 52.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.678 0.275 . . . . 0.0 111.422 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -121.48 3.17 10.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.6 tt -96.28 121.91 47.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.327 0.584 . . . . 0.0 110.834 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.8 t -124.48 121.98 62.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.075 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 60.3 mt -91.76 105.85 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 34.1 m -98.75 150.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.264 0.554 . . . . 0.0 111.296 -175.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.53 126.58 8.68 Favored Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.841 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' HG23 ' A' ' 68' ' ' THR . 85.4 mt -100.72 19.0 17.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.182 0.515 . . . . 0.0 109.853 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.1 m -61.27 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.583 -176.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.65 -51.47 11.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.281 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 49.1 mt -89.28 108.68 19.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.469 -176.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.22 12.13 19.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.824 0.345 . . . . 0.0 111.227 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -112.89 34.52 4.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.304 0.573 . . . . 0.0 109.572 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 62' ' ' LEU . 5.8 p -89.3 2.53 54.21 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -80.22 -11.32 59.75 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.944 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.37 -25.03 63.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.295 172.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.26 158.61 28.51 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.536 174.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -142.86 154.45 44.15 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.722 178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.51 118.07 14.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.155 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 106.2 22.69 7.73 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.136 -0.785 . . . . 0.0 111.136 -175.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -113.48 165.08 12.82 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -127.42 124.39 38.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.922 0.392 . . . . 0.0 110.554 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.536 HG22 ' HA ' ' A' ' 99' ' ' LEU . 39.5 pt -130.24 153.14 38.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.782 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.427 ' HE3' ' CZ2' ' A' ' 80' ' ' TRP . 35.9 ttpt -111.8 110.66 21.14 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.488 HG21 ' O ' ' A' ' 16' ' ' LEU . 8.6 m -99.6 159.23 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 111.869 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.427 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 20.9 m-90 -127.77 128.41 45.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.467 173.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -134.83 175.17 9.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.155 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -95.81 -37.75 10.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.161 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.1 t -154.71 157.19 37.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.501 ' HG3' ' HB1' ' A' ' 92' ' ' ALA . 50.7 ttp180 -121.39 134.92 55.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -88.11 125.26 34.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.951 0.405 . . . . 0.0 110.376 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -80.83 74.52 7.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.209 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -86.68 -24.3 25.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.899 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 33.4 t30 61.09 92.17 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.685 -174.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.44 156.75 96.76 Favored 'Cis proline' 0 C--N 1.345 0.355 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.392 -0.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.11 139.88 92.56 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.863 2.375 . . . . 0.0 112.662 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.1 p -135.31 142.75 45.89 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.501 ' HB1' ' HG3' ' A' ' 84' ' ' ARG . . . -158.28 139.06 12.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.706 0.289 . . . . 0.0 111.19 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -81.17 115.77 20.75 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.4 pt -86.31 135.83 24.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.123 0.487 . . . . 0.0 110.488 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -106.05 -22.89 12.77 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.979 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.432 ' HD2' ' SD ' ' A' ' 13' ' ' MET . 65.2 mttp -142.88 147.34 35.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.915 177.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.467 ' HB3' HG13 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -152.81 156.77 39.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.987 0.423 . . . . 0.0 110.677 171.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -114.84 112.0 22.09 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.536 ' HA ' HG22 ' A' ' 77' ' ' ILE . 6.1 tt -72.31 113.31 9.21 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.9 mt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.201 -172.685 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.608 ' HE2' ' HB2' ' A' ' 95' ' ' GLN . 75.4 mtp . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 85.1 mm-40 -83.76 115.19 22.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.089 0.471 . . . . 0.0 109.865 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.6 t -96.93 129.9 44.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.222 -172.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.9 137.37 29.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.7 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 62.1 t -97.68 137.76 24.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 154.5 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.432 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.7 127.14 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.409 ' HA ' HD21 ' A' ' 30' ' ' LEU . 10.9 t -83.02 102.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 p -120.51 -49.41 3.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.591 ' HB3' ' HB ' ' A' ' 29' ' ' ILE . 25.8 tp -122.7 138.76 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.773 0.32 . . . . 0.0 110.855 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.4 ' HZ1' ' C ' ' A' ' 72' ' ' LYS . 37.9 mttp -131.06 162.87 28.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.869 0.366 . . . . 0.0 110.781 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -123.05 -69.87 0.8 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.351 171.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -166.09 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.936 176.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -93.8 -15.43 25.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.243 0.544 . . . . 0.0 110.268 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -116.49 141.37 48.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.811 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -121.41 145.94 47.4 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.425 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.591 ' HB ' ' HB3' ' A' ' 22' ' ' LEU . 66.6 mt -107.33 108.17 24.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.963 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 20' ' ' VAL . 58.8 mt -116.06 149.8 38.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.981 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.432 HD13 ' HG3' ' A' ' 37' ' ' PRO . 54.6 mt -109.26 122.05 63.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.9 p -94.3 7.56 44.96 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.588 ' CG ' ' H ' ' A' ' 34' ' ' THR . 31.9 t70 -163.58 -162.73 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.588 ' H ' ' CG ' ' A' ' 33' ' ' ASP . 6.5 m 82.15 23.07 0.23 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.686 0.795 . . . . 0.0 111.854 175.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.0 tttm 56.8 42.52 26.5 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.414 169.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.63 134.36 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.543 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.432 ' HG3' HD13 ' A' ' 31' ' ' ILE . 45.1 Cg_exo -56.25 136.58 76.07 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.826 2.351 . . . . 0.0 112.107 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.63 -163.34 30.3 Favored Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.713 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -52.64 -58.29 7.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.859 0.464 . . . . 0.0 111.89 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.604 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -68.34 -27.29 66.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -67.76 -30.55 70.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.83 0.348 . . . . 0.0 110.648 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -83.49 -1.77 54.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.845 0.355 . . . . 0.0 111.06 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -110.6 -10.97 14.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 93.1 mt -79.6 149.15 31.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.031 0.443 . . . . 0.0 111.248 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.7 m -88.77 -178.93 5.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.242 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -55.2 -60.84 2.83 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.03 -33.97 86.1 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.569 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -71.49 -37.26 71.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.362 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.97 -42.77 94.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.566 176.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.411 ' HE1' ' HG3' ' A' ' 89' ' ' PRO . 80.4 mtp -66.77 -23.64 66.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.922 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -74.95 -42.24 58.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.856 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -77.17 -45.71 25.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 110.668 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.532 ' O ' HG22 ' A' ' 57' ' ' ILE . 89.2 m-85 -98.81 44.65 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -175.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -44.09 -39.2 4.07 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -121.29 9.81 10.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -176.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -120.22 -5.45 9.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.8 tt -99.37 132.06 45.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.928 0.394 . . . . 0.0 109.955 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 63.5 t -122.97 126.97 74.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.945 0.403 . . . . 0.0 110.617 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.6 mt -96.72 100.91 11.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.6 m -89.1 141.99 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.124 0.488 . . . . 0.0 111.374 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.77 115.33 4.63 Favored Glycine 0 N--CA 1.441 -0.996 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.18 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.45 HD12 ' HB3' ' A' ' 28' ' ' ALA . 80.4 mt -94.47 27.09 3.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 0.0 110.123 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.5 m -55.57 -35.84 66.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.89 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.429 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 14.8 mm-40 -81.87 -6.91 59.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 111.092 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -114.32 99.91 9.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -68.45 -41.06 80.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.414 -174.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -107.01 106.75 17.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.929 0.395 . . . . 0.0 110.737 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -98.3 18.58 16.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.425 0.631 . . . . 0.0 109.517 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.39 -29.83 70.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.304 -171.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -81.28 -17.81 48.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt -71.5 125.06 26.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.908 0.385 . . . . 0.0 110.568 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.4 ' C ' ' HZ1' ' A' ' 23' ' ' LYS . 22.4 mttp -106.68 -172.59 2.11 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.878 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -111.36 126.01 54.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 33.65 5.36 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.781 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.09 179.58 3.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 111.103 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -129.44 129.6 44.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.397 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.531 HG21 ' HA ' ' A' ' 99' ' ' LEU . 30.1 pt -130.84 145.13 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.019 0.438 . . . . 0.0 111.275 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.66 ' HZ2' ' HB3' ' A' ' 78' ' ' LYS . 8.1 ttpm? -106.34 107.27 18.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.2 m -98.24 154.25 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.019 0.438 . . . . 0.0 111.711 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.551 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 23.2 m-90 -121.34 115.45 22.97 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.132 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.497 ' HB3' HG21 ' A' ' 94' ' ' ILE . 5.5 p90 -118.01 166.83 12.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.556 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -126.97 -25.61 3.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.357 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.8 m -117.86 111.61 19.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.937 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.7 mtm180 -108.45 140.1 42.25 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.035 172.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -121.59 110.23 15.74 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -79.25 87.6 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.985 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.4 p -102.15 -26.78 13.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.207 177.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.5 m120 57.98 90.96 0.08 OUTLIER Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.348 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.411 ' HG3' ' HE1' ' A' ' 50' ' ' MET . 46.3 Cg_endo -67.82 136.04 32.19 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.81 1.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.75 153.31 29.69 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.61 2.207 . . . . 0.0 113.039 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -116.01 153.64 31.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.336 176.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -148.08 132.82 17.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.743 0.306 . . . . 0.0 110.758 -179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.9 m -90.71 116.22 28.41 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.936 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.497 HG21 ' HB3' ' A' ' 81' ' ' PHE . 46.8 pt -101.66 148.59 7.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.946 0.403 . . . . 0.0 110.725 -178.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.608 ' HB2' ' HE2' ' A' ' 13' ' ' MET . 97.0 mt-30 -111.44 -28.2 8.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.36 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -136.94 152.83 50.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.725 -179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -154.56 144.95 22.1 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -114.55 118.26 33.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.047 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.531 ' HA ' HG21 ' A' ' 77' ' ' ILE . 3.0 tt -77.62 111.11 13.04 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 76.4 mt . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.426 -175.505 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.0 mtm . . . . . 0 CA--C 1.519 -0.229 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -83.78 125.45 31.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.981 0.42 . . . . 0.0 110.474 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.0 m -85.24 124.72 32.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.539 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 32' ' ' THR . 2.9 tm? -121.98 112.85 18.79 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.1 t -93.36 115.23 31.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 -172.07 18.12 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.752 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.35 136.06 54.82 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.923 0.392 . . . . 0.0 110.918 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.427 HG23 ' CD2' ' A' ' 30' ' ' LEU . 13.0 t -85.59 93.82 3.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.497 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 m -82.64 -34.98 12.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.842 -178.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.669 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.7 mt -133.52 127.58 33.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.107 0.479 . . . . 0.0 110.613 178.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -111.92 126.27 54.93 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.271 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.778 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 37.0 t70 -128.21 166.4 18.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 81.1 m-20 -67.77 106.56 2.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.835 0.35 . . . . 0.0 110.141 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 47.7 mt-10 78.82 5.81 2.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.645 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.778 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 9.3 mpt_? -127.83 119.61 26.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.914 0.388 . . . . 0.0 110.955 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -110.27 107.98 17.93 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 62.8 mt -85.73 104.35 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.49 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.427 ' CD2' HG23 ' A' ' 20' ' ' VAL . 36.5 mt -111.54 151.74 28.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.529 -171.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.6 mt -97.45 123.71 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 168.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.477 ' HA ' HD13 ' A' ' 16' ' ' LEU . 12.2 p -78.6 -10.59 59.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.018 0.437 . . . . 0.0 111.396 -177.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.491 ' OD1' ' HG3' ' A' ' 35' ' ' LYS . 6.1 t70 -89.64 162.05 15.81 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.9 p -100.96 9.59 42.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.491 ' HG3' ' OD1' ' A' ' 33' ' ' ASP . 68.0 mttm -77.25 131.7 38.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.238 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.5 122.79 73.39 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.504 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 165.89 30.94 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.797 2.332 . . . . 0.0 112.168 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.72 -172.59 27.96 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.776 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.77 -41.27 99.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.027 0.441 . . . . 0.0 110.488 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 34.4 tt0 -64.71 -37.12 86.52 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.39 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.448 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 m-20 -60.53 -45.03 95.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -70.88 -14.35 62.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.527 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -93.91 -15.44 24.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.752 0.31 . . . . 0.0 110.749 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.3 mt -72.53 154.19 40.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.2 176.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.1 p -84.98 170.14 13.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -176.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -50.24 -48.75 54.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.236 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.3 -43.18 99.45 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.616 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -70.92 -35.96 72.46 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.77 -0.253 . . . . 0.0 111.348 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 41' ' ' ASP . 67.3 mt -68.91 -36.92 78.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.89 0.376 . . . . 0.0 110.471 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.471 ' HA ' HG21 ' A' ' 57' ' ' ILE . 42.6 ttm -61.78 -34.58 76.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.504 176.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -82.71 -44.35 15.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.319 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.09 -34.32 74.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -114.41 43.1 1.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.121 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -50.63 119.53 3.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.107 -176.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 69.15 0.19 2.73 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.75 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -96.15 -20.42 18.62 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 170.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.471 HG21 ' HA ' ' A' ' 50' ' ' MET . 8.4 tt -90.24 123.32 42.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.358 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -125.51 125.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.251 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.65 HG12 HG12 ' A' ' 29' ' ' ILE . 58.0 mt -94.57 108.86 21.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 24.8 m -98.25 143.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.471 . . . . 0.0 110.88 -179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.44 134.0 12.7 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.102 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 69.4 mt -105.42 16.33 25.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.827 0.346 . . . . 0.0 110.245 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.2 m -60.54 -33.07 72.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.303 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.41 -33.87 61.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.684 0.278 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.7 mt -108.33 97.73 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.304 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.51 6.78 22.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.28 0.562 . . . . 0.0 110.88 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -99.12 14.51 29.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.21 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.512 HG22 HD23 ' A' ' 62' ' ' LEU . 6.9 p -86.4 7.64 24.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.62 -12.46 59.5 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.281 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.77 -19.99 61.93 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.981 174.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.426 HD23 HG21 ' A' ' 20' ' ' VAL . 25.3 tp -67.54 147.35 52.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.61 178.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -119.47 172.4 7.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.185 0.516 . . . . 0.0 111.73 -178.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -84.9 126.25 33.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.489 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.11 26.31 19.3 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -175.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -95.64 160.04 14.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 111.142 -173.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.514 ' HG2' HD12 ' A' ' 100' ' ' LEU . 46.4 tttp -117.92 111.31 18.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -177.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.451 HG23 HD11 ' A' ' 99' ' ' LEU . 44.5 pt -132.4 171.84 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.745 0.783 . . . . 0.0 112.943 -173.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -133.45 111.65 10.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.882 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.482 ' HB ' HG22 ' A' ' 94' ' ' ILE . 34.9 m -106.62 157.43 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -117.39 123.06 45.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.098 172.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -126.22 157.71 37.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.813 0.34 . . . . 0.0 110.554 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -87.4 -36.88 17.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.093 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.8 t -150.11 168.61 23.42 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.238 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -123.77 132.0 53.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -110.21 95.24 5.46 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -82.81 84.6 7.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.198 0.523 . . . . 0.0 110.996 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 m -84.78 -12.47 53.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.115 175.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.7 m120 60.31 89.99 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.546 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 58.3 Cg_endo -70.13 151.24 92.23 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.877 -1.301 . . . . 0.0 113.132 2.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 11.0 Cg_exo -71.14 153.11 62.58 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.096 2.53 . . . . 0.0 113.107 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 t -135.4 160.91 36.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.654 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.53 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -158.14 170.66 21.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 23.9 m -131.74 130.9 42.51 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.482 HG22 ' HB ' ' A' ' 79' ' ' VAL . 44.5 pt -109.09 145.05 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.966 0.412 . . . . 0.0 111.158 -176.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -109.13 -16.24 14.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -161.71 147.72 13.78 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -152.19 164.9 36.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -114.8 136.45 53.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.867 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.451 HD11 HG23 ' A' ' 77' ' ' ILE . 29.8 tp -92.26 118.88 31.32 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.514 HD12 ' HG2' ' A' ' 76' ' ' LYS . 93.7 mt . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.196 0.522 . . . . 0.0 110.582 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.406 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 67.4 mtm . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.39 116.55 22.54 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 12.3 t -103.9 144.57 31.33 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.199 0.523 . . . . 0.0 111.694 -171.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.517 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.0 OUTLIER -135.52 136.99 41.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.49 ' N ' HD11 ' A' ' 16' ' ' LEU . 58.7 t -106.19 124.11 61.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.7 0.286 . . . . 0.0 110.393 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.25 167.72 29.0 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.11 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -104.94 128.01 53.02 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.477 HG23 HD11 ' A' ' 71' ' ' LEU . 21.9 t -75.69 99.2 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.444 HG12 ' CE2' ' A' ' 42' ' ' TYR . 34.6 m -98.27 -38.73 7.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.671 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.708 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 94.4 mt -131.46 131.5 43.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.667 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -116.07 119.77 36.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.548 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -88.42 -73.69 0.49 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.396 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 171.73 -64.13 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.66 -25.72 21.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.141 175.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.9 OUTLIER -116.55 151.89 35.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.694 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' A' ' 62' ' ' LEU . . . -129.35 127.84 41.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.65 173.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.708 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 68.0 mt -89.68 107.93 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.2 mt -111.24 137.72 48.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.486 -177.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.431 HD13 HD11 ' A' ' 49' ' ' LEU . 9.7 mt -105.27 148.76 9.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.461 HG22 HD13 ' A' ' 16' ' ' LEU . 19.1 p -128.76 155.18 45.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.268 -176.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 54.28 41.26 32.08 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.631 0.582 . . . . 0.0 111.122 176.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -108.77 -4.59 16.81 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.011 -175.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.37 36.06 23.26 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.956 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 64.34 107.45 0.03 OUTLIER Pre-proline 0 N--CA 1.464 0.253 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.87 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.404 ' HG2' ' CE1' ' A' ' 42' ' ' TYR . 26.4 Cg_endo -63.14 163.67 22.14 Favored 'Trans proline' 0 C--O 1.237 0.443 0 C-N-CA 122.802 2.334 . . . . 0.0 112.293 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.458 ' O ' ' HD1' ' A' ' 42' ' ' TYR . . . -89.82 172.22 38.54 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.887 -178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.18 -25.54 68.12 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.659 0.266 . . . . 0.0 111.128 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.88 -29.96 56.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.071 0.462 . . . . 0.0 110.175 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -69.95 -35.7 74.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.458 ' HD1' ' O ' ' A' ' 38' ' ' GLY . 69.3 m-85 -71.12 -16.21 62.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.458 174.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -83.41 -28.94 28.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.045 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -67.9 142.55 56.03 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.306 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 m -91.32 -174.14 3.84 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.474 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -52.55 -56.22 16.75 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.026 -173.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.91 92.74 Favored Glycine 0 N--CA 1.454 -0.144 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.388 -177.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.63 -39.33 80.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.578 0.228 . . . . 0.0 111.148 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.431 HD11 HD13 ' A' ' 31' ' ' ILE . 90.7 mt -78.26 -35.67 47.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.964 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 42.9 ttm -58.83 -42.73 89.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -93.24 2.76 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.463 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -100.56 -40.48 7.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.196 0.522 . . . . 0.0 109.76 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 56' ' ' ASN . 81.0 m-85 -118.58 55.58 0.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.59 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -51.5 -35.95 42.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.5 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -100.42 -8.77 22.88 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.593 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 53' ' ' PHE . 2.9 m-20 -114.02 2.03 14.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -171.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 12.6 tt -98.48 123.74 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.113 0.482 . . . . 0.0 110.861 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -125.02 126.02 70.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.967 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 91' ' ' SER . 61.6 mt -97.84 105.18 16.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.9 m -90.68 150.44 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.277 -176.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.66 119.59 6.53 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.883 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' A' ' 28' ' ' ALA . 35.4 mt -92.33 7.99 40.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.09 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.0 t -65.46 -23.69 66.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.296 -170.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -97.72 5.52 49.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.088 0.47 . . . . 0.0 111.214 -175.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 52.3 mt -95.75 154.96 3.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.253 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -68.93 0.13 Allowed 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.363 0.414 . . . . 0.0 110.928 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -163.41 131.04 3.55 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.494 HG21 HD13 ' A' ' 62' ' ' LEU . 37.0 p -97.29 35.3 1.63 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.039 -174.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -68.28 -22.56 64.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.091 -177.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -92.95 5.93 49.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.112 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.477 HD11 HG23 ' A' ' 20' ' ' VAL . 24.1 tp -99.02 121.19 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.365 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -114.1 -172.57 2.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.954 0.407 . . . . 0.0 110.544 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -85.47 146.1 27.11 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.479 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.417 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 76.46 39.93 29.19 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.636 174.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -127.02 158.62 36.45 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.619 -177.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.5 mttp -102.62 136.45 42.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.4 pt -133.1 140.44 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.336 0.589 . . . . 0.0 111.25 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -100.29 106.82 18.5 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 173.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 15' ' ' SER . 29.2 m -100.16 154.11 4.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.582 -172.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.494 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 18.6 m-90 -120.61 117.65 28.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.414 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.531 ' HB3' HG23 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -133.88 167.15 21.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.825 -175.354 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -152.37 -37.7 0.11 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.739 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.433 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 7.1 m -80.23 108.02 13.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.451 176.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -102.52 153.51 20.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.148 0.499 . . . . 0.0 111.532 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.622 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 98.0 mttt -133.6 114.01 13.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.747 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.9 58.31 3.35 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.852 0.834 . . . . 0.0 109.697 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.6 t -76.37 -16.4 59.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.171 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 p30 42.92 100.08 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 112.382 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.15 150.07 75.3 Favored 'Cis proline' 0 C--N 1.345 0.381 0 C-N-CA 123.804 -1.332 . . . . 0.0 113.053 3.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.47 136.54 74.96 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.014 2.476 . . . . 0.0 112.524 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.622 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 19.7 m -115.72 149.03 39.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.567 177.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.418 ' HB2' ' CD2' ' A' ' 81' ' ' PHE . . . -143.53 121.63 12.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.794 0.33 . . . . 0.0 111.258 -177.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.433 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 29.3 m -82.07 113.67 20.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.531 HG23 ' HB3' ' A' ' 81' ' ' PHE . 35.2 pt -96.18 142.58 13.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.033 0.444 . . . . 0.0 110.697 -177.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -90.59 -19.28 23.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.092 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -171.01 150.26 3.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.655 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.77 157.94 31.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 23.2 tt0 -115.54 112.34 22.06 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.5 tp -71.58 107.18 4.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.739 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.5 mt . . . . . 0 C--N 1.322 -0.602 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.477 179.467 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.537 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 95.8 mmm . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.512 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 83.9 mm-40 -83.38 118.62 23.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 111.195 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 m -81.15 111.9 18.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.457 HD13 HG23 ' A' ' 32' ' ' THR . 2.0 tm? -130.92 124.89 32.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.75 132.3 37.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.786 0.327 . . . . 0.0 110.327 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.59 162.78 28.93 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.755 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -105.84 126.03 51.7 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.576 0.227 . . . . 0.0 110.648 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.44 107.62 4.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.448 HG12 ' HG ' ' A' ' 22' ' ' LEU . 12.2 p -120.23 -32.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 123.271 0.357 . . . . 0.0 111.062 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.965 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.9 mt -127.73 145.07 51.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.818 0.342 . . . . 0.0 110.999 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -119.1 135.8 54.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.35 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 0.9 OUTLIER -92.77 -66.77 0.9 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.141 171.128 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.544 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 6.1 t30 160.9 -51.45 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.18 -24.76 14.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.406 -1.27 . . . . 0.0 108.69 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 24.3 mtm180 -117.92 158.95 23.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.607 -1.178 . . . . 0.0 110.464 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.502 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -124.61 139.87 53.47 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 175.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.965 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 32.5 mt -102.41 109.29 26.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 mt -113.16 144.39 42.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.047 -172.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.76 119.74 35.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.883 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.457 HG23 HD13 ' A' ' 16' ' ' LEU . 75.9 p -81.78 -23.66 36.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.959 0.409 . . . . 0.0 110.665 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -78.48 95.08 5.05 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 t -63.88 90.69 0.06 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.155 0.978 . . . . 0.0 112.127 -173.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -138.35 135.56 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.656 -1.157 . . . . 0.0 108.356 172.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.35 113.24 15.41 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.498 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.0 158.02 50.27 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.62 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.37 168.99 48.92 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.938 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -64.1 -28.12 69.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.948 0.404 . . . . 0.0 110.593 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -81.38 -26.56 35.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.911 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.67 -34.73 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -69.33 -16.19 63.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.665 175.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -94.53 -18.06 21.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.772 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.92 152.87 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.117 0.484 . . . . 0.0 110.953 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.3 p -77.51 166.62 22.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.322 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.406 ' HA ' ' CD1' ' A' ' 22' ' ' LEU . 37.2 tt0 -52.77 -52.69 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.936 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.68 -42.13 99.71 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.686 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -68.04 -37.38 81.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.754 0.277 . . . . 0.0 111.654 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.506 HD12 HD23 ' A' ' 22' ' ' LEU . 72.8 mt -70.42 -34.17 72.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.796 0.331 . . . . 0.0 110.501 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.422 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 62.7 mtt -73.22 -15.7 61.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.094 176.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -91.04 -40.16 11.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.861 0.363 . . . . 0.0 110.35 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.31 -47.71 69.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.449 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.65 46.86 0.94 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.81 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 50' ' ' MET . 57.0 tttp -56.27 131.14 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -176.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 69.19 -5.52 1.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.276 -0.874 . . . . 0.0 112.206 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -106.14 9.75 32.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.579 0.704 . . . . 0.0 109.495 176.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 20.2 tt -120.48 128.62 76.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.603 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.509 HG23 ' HG2' ' A' ' 90' ' ' PRO . 53.7 t -121.98 137.84 54.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.893 0.378 . . . . 0.0 110.969 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 91' ' ' SER . 56.5 mt -95.93 111.13 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.97 139.03 18.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.155 0.502 . . . . 0.0 111.231 -177.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -87.57 113.09 3.93 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.502 HD12 ' HB3' ' A' ' 28' ' ' ALA . 59.5 mt -87.55 43.13 1.09 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.026 0.441 . . . . 0.0 110.39 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.4 t -59.52 -45.51 91.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.654 -176.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.661 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 1.1 mp0 -87.86 11.09 16.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.05 0.453 . . . . 0.0 111.27 -176.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.4 mm -106.45 134.38 48.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.44 -64.27 1.21 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.163 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -123.69 140.64 52.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.7 p -111.45 27.58 9.54 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.163 0.506 . . . . 0.0 111.551 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -73.01 -25.13 60.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.189 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -74.59 -27.22 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.692 0.282 . . . . 0.0 111.118 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.06 125.13 25.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -114.74 150.98 34.49 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 48.2 mtm105 -68.83 112.46 5.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 171.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.0 33.38 4.67 Favored Glycine 0 N--CA 1.443 -0.897 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 -174.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -118.53 151.38 37.96 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HG2' HD12 ' A' ' 100' ' ' LEU . 81.1 tttt -111.8 122.99 49.3 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.827 0.346 . . . . 0.0 110.755 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.431 HG21 HD13 ' A' ' 99' ' ' LEU . 38.2 pt -132.14 149.6 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.296 0.57 . . . . 0.0 111.347 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -105.96 108.13 19.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.487 HG13 ' HB3' ' A' ' 97' ' ' TYR . 28.2 m -98.66 153.02 4.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.255 0.55 . . . . 0.0 111.632 -173.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.537 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 8.5 m-90 -121.2 113.46 20.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.802 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.61 ' HA ' ' HA ' ' A' ' 94' ' ' ILE . 30.4 p90 -107.24 146.93 30.84 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.619 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -99.22 -25.17 14.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.326 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -160.29 152.59 20.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.454 ' HA ' ' HA ' ' A' ' 92' ' ' ALA . 32.9 mtm180 -110.25 169.75 8.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.344 0.592 . . . . 0.0 111.064 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 91' ' ' SER . 57.5 tttp -140.74 91.39 2.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.015 -0.993 . . . . 0.0 108.47 173.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.534 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 35.2 tt0 -83.96 109.81 17.92 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.363 -173.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -121.08 -0.27 10.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.417 174.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 59.37 102.08 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.47 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.212 -175.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.42 146.07 72.14 Favored 'Cis proline' 0 C--N 1.344 0.301 0 C-N-CA 123.563 -1.432 . . . . 0.0 112.24 0.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.534 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_endo -62.82 138.78 70.82 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.489 2.126 . . . . 0.0 112.202 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 28.2 t -104.0 156.09 18.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 84' ' ' ARG . . . -147.56 108.58 4.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.685 0.278 . . . . 0.0 110.911 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.4 m -73.02 110.08 7.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.859 0.361 . . . . 0.0 110.601 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.61 ' HA ' ' HA ' ' A' ' 81' ' ' PHE . 45.4 pt -98.95 147.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.356 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.661 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 96.7 mt-30 -109.61 -8.98 14.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.581 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -165.98 148.74 7.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.172 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' HB3' HG13 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -137.35 167.37 21.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 172.475 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -129.32 131.06 46.84 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.431 HD13 HG21 ' A' ' 77' ' ' ILE . 17.4 tp -79.17 111.87 15.83 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -178.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.474 HD12 ' HG2' ' A' ' 76' ' ' LYS . 86.0 mt . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.983 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.408 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 72.8 mtp . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.768 0.318 . . . . 0.0 110.333 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.46 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.4 mt-30 -88.67 135.3 33.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.848 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.578 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 35.8 p -101.67 139.43 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.634 -174.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.3 tp -140.34 120.82 14.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.542 177.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.429 HG22 ' HB2' ' A' ' 78' ' ' LYS . 55.9 t -90.23 127.01 43.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.293 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.64 158.6 27.73 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.148 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.78 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 80.0 m-85 -99.37 129.77 45.6 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.494 HG22 HD12 ' A' ' 71' ' ' LEU . 13.8 t -83.07 108.4 15.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.227 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.2 m -103.34 -28.48 3.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 123.318 0.386 . . . . 0.0 111.033 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.89 HD23 HD13 ' A' ' 29' ' ' ILE . 39.2 tp -136.21 122.82 20.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.869 0.366 . . . . 0.0 110.55 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -105.96 123.57 48.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.659 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -113.04 167.57 10.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.84 -31.96 68.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.63 0.252 . . . . 0.0 111.517 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -122.76 1.86 9.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.593 0.235 . . . . 0.0 111.324 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -142.83 167.78 21.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.82 0.343 . . . . 0.0 110.665 -174.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.473 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -145.72 119.66 9.35 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.8 173.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.89 HD13 HD23 ' A' ' 22' ' ' LEU . 33.3 mt -85.73 107.86 16.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-O 121.217 0.532 . . . . 0.0 110.014 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.431 ' CD2' HG21 ' A' ' 20' ' ' VAL . 20.2 mt -110.44 141.94 42.85 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.163 -176.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.407 ' CG2' ' HG1' ' A' ' 34' ' ' THR . 60.4 mt -101.92 122.13 53.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 172.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -71.47 91.77 1.06 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.083 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.78 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 45.9 t0 65.22 93.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.848 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.407 ' HG1' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -101.44 10.66 40.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.233 177.683 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 56.13 35.66 26.06 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -172.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.43 102.98 0.03 OUTLIER Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.61 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.4 157.21 32.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.869 2.38 . . . . 0.0 112.391 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.11 166.85 39.11 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.641 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -57.67 -37.38 73.29 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.744 0.307 . . . . 0.0 111.06 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.434 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 19.2 mm-40 -73.84 -24.01 59.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.64 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.6 -33.87 71.53 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.507 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 80.5 m-85 -74.82 -17.92 60.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.363 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -90.12 -12.62 37.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.062 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 85.5 mt -67.42 166.14 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.129 0.49 . . . . 0.0 111.079 176.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.1 p -97.65 171.78 8.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.1 tt0 -53.82 -55.8 23.35 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.303 -177.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -57.9 -41.19 94.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.264 -0.493 . . . . 0.0 112.842 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -63.42 -44.38 94.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.738 0.304 . . . . 0.0 110.692 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.68 -42.74 98.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 88.9 mtp -60.22 -33.88 72.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.652 -179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -92.22 -34.89 14.1 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -71.33 -47.78 54.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.9 0.381 . . . . 0.0 110.425 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -106.04 44.08 1.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.633 0.73 . . . . 0.0 109.86 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 81.3 tttt -54.62 140.6 34.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.246 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 92.7 m-20 76.37 -40.96 0.4 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.62 0.768 . . . . 0.0 112.329 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -80.83 -1.04 41.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 0.0 110.806 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.479 HG22 ' HB3' ' A' ' 89' ' ' PRO . 7.4 tt -90.8 118.77 36.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.308 0.575 . . . . 0.0 110.43 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -117.92 125.19 74.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.108 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.671 HG12 HG12 ' A' ' 29' ' ' ILE . 55.1 mt -99.49 100.35 10.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.43 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 35.5 m -83.66 154.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.403 ' CA ' ' HA ' ' A' ' 93' ' ' THR . . . -96.41 125.95 8.63 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.934 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.534 ' HB3' HG23 ' A' ' 68' ' ' THR . 86.6 mt -109.31 9.74 25.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 -178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -64.78 -21.99 66.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.451 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -91.88 0.66 57.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.709 0.29 . . . . 0.0 111.156 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.34 117.8 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.868 0.365 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.76 -55.88 6.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.047 0.451 . . . . 0.0 111.658 -176.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -85.35 66.85 9.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.208 0.528 . . . . 0.0 111.736 -173.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.534 HG23 ' HB3' ' A' ' 62' ' ' LEU . 69.1 p -99.54 8.9 44.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.229 172.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.79 -18.92 65.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.731 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -77.51 -12.43 59.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.302 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.54 HD11 ' HG3' ' A' ' 75' ' ' GLU . 15.5 tp -87.92 126.25 34.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.792 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.413 ' HD2' ' OE2' ' A' ' 75' ' ' GLU . 35.8 mttt -112.76 -179.82 3.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.133 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -88.57 59.56 5.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.85 0.357 . . . . 0.0 110.417 174.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.507 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 176.54 42.61 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.54 ' HG3' HD11 ' A' ' 71' ' ' LEU . 40.5 mm-40 -111.87 173.18 6.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.288 0.566 . . . . 0.0 111.441 -173.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -137.48 102.23 4.72 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.641 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.1 pt -125.44 154.9 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.764 0.793 . . . . 0.0 113.093 -170.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.49 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 43.3 tttt -115.77 106.44 13.86 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.301 -1.318 . . . . 0.0 108.551 175.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.578 ' O ' ' HA ' ' A' ' 15' ' ' SER . 22.1 m -96.14 156.86 3.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -169.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.49 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 5.4 m-90 -122.99 126.44 47.16 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.338 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -136.86 160.16 39.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.584 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -96.45 -23.08 16.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -157.57 158.51 35.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.124 -174.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -122.98 154.16 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.18 0.514 . . . . 0.0 110.805 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -103.68 102.51 12.37 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -77.85 62.24 2.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.911 -175.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.7 p -81.66 -30.15 32.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.031 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 66.3 101.72 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.42 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.669 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.479 ' HB3' HG22 ' A' ' 57' ' ' ILE . 31.3 Cg_endo -63.11 142.13 42.3 Favored 'Cis proline' 0 C--N 1.347 0.484 0 C-N-CA 123.779 -1.342 . . . . 0.0 112.657 2.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.91 134.91 63.26 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.79 2.327 . . . . 0.0 112.159 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 p -123.45 144.59 49.41 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.85 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -151.26 110.3 3.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.285 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.403 ' HA ' ' CA ' ' A' ' 61' ' ' GLY . 12.8 m -68.29 117.25 9.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.216 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.505 HG23 ' HB ' ' A' ' 79' ' ' VAL . 42.5 pt -100.6 151.77 5.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.154 0.502 . . . . 0.0 110.938 -176.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -112.78 -18.65 12.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.338 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -143.1 151.13 40.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.777 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.446 ' HB3' HD13 ' A' ' 94' ' ' ILE . 1.2 p90 -155.93 150.01 25.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.965 0.412 . . . . 0.0 110.02 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.44 124.47 52.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.413 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.63 117.67 23.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.952 0.406 . . . . 0.0 110.393 -177.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.084 179.813 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 70.3 mtm . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 120.848 0.356 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -83.66 121.11 26.82 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.263 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.519 ' HB3' ' HE2' ' A' ' 78' ' ' LYS . 48.8 m -85.42 129.24 34.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.123 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -137.5 124.56 21.54 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.8 t -90.31 126.67 43.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.99 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.44 169.31 29.05 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.359 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.402 ' CD2' ' HG2' ' A' ' 76' ' ' LYS . 94.2 m-85 -107.14 133.96 50.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.657 0.265 . . . . 0.0 110.353 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.0 t -85.39 110.27 19.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.34 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.8 t -107.23 -63.19 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 123.497 0.498 . . . . 0.0 110.704 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 1.018 HD22 HD12 ' A' ' 29' ' ' ILE . 41.6 tp -111.51 110.47 20.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.948 0.404 . . . . 0.0 110.702 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' ' 69' ' ' ASP . 42.6 tttm -100.01 126.58 46.22 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 15.7 t70 -106.27 -158.08 0.64 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 174.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.498 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 72.9 m-20 -89.1 -54.72 3.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.172 0.511 . . . . 0.0 109.747 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -98.26 -10.72 23.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.027 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.2 mtt180 -131.87 149.7 52.37 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.733 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -127.13 115.36 19.0 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 172.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 1.018 HD12 HD22 ' A' ' 22' ' ' LEU . 34.7 mt -87.94 107.55 17.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.394 0.616 . . . . 0.0 110.396 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 29.3 mt -114.32 158.13 21.86 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.416 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . 0.546 ' CG2' ' HB ' ' A' ' 34' ' ' THR . 36.9 mt -110.37 123.8 66.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.3 p -78.14 107.85 11.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.375 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 54.05 75.49 0.27 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.634 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.546 ' HB ' ' CG2' ' A' ' 31' ' ' ILE . 10.0 t -108.56 -0.01 20.56 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.637 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.8 mttp 57.11 41.18 27.67 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.837 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.98 112.57 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.8 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.507 ' HG3' HG22 ' A' ' 34' ' ' THR . 6.5 Cg_exo -73.03 178.88 5.95 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.833 2.356 . . . . 0.0 111.469 176.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.5 166.23 25.27 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.31 -178.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -62.79 -27.21 69.15 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.6 mt-10 -59.71 -47.6 85.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.363 174.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -67.04 -32.87 74.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.833 -175.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.492 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 53.6 m-85 -73.45 -16.44 61.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 111.058 177.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -93.44 -22.14 19.08 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.07 0.462 . . . . 0.0 110.143 178.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 89.7 mt -69.52 157.1 37.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.056 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -88.1 179.07 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.363 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -58.9 -43.58 91.06 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.346 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.8 -42.27 93.13 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.478 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.16 -39.53 94.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.065 0.46 . . . . 0.0 110.429 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.2 tp -68.96 -48.38 63.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.34 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 41.3 ttm -55.88 -49.02 74.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.918 -174.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -81.98 -8.43 59.67 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -90.11 -51.5 5.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.003 0.43 . . . . 0.0 110.408 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -101.75 33.24 3.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -56.89 -29.52 63.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -170.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -101.44 3.43 40.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.452 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -132.84 18.16 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.124 0.487 . . . . 0.0 110.063 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.439 HD13 ' CG2' ' A' ' 29' ' ' ILE . 17.5 tt -109.75 134.08 52.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.744 -174.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.4 t -132.64 122.59 47.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.042 0.448 . . . . 0.0 110.448 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.709 HG12 HG12 ' A' ' 29' ' ' ILE . 48.4 mt -92.99 103.62 14.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.46 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.469 ' CG2' ' HB2' ' A' ' 28' ' ' ALA . 34.0 m -83.1 145.64 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.136 0.493 . . . . 0.0 110.714 -178.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.75 122.41 6.65 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.103 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' HB3' ' A' ' 28' ' ' ALA . 68.5 mt -98.98 11.62 38.41 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.925 0.426 . . . . 0.0 110.188 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 m -57.42 -25.16 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.675 -174.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -98.37 6.47 47.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.158 0.504 . . . . 0.0 111.015 -176.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.0 mt -125.25 107.02 17.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -84.63 21.19 1.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.817 0.341 . . . . 0.0 111.792 -174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -157.77 81.58 0.87 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.16 0.505 . . . . 0.0 109.769 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.495 HG21 ' HB3' ' A' ' 62' ' ' LEU . 10.2 p -114.21 9.08 17.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.908 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.514 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 41.7 m-20 -79.49 2.67 21.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.115 0.483 . . . . 0.0 111.292 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -82.29 -13.7 56.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.576 170.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.8 tp -76.2 130.63 38.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.468 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.558 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 4.2 mtpm? -106.02 165.12 11.44 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.393 -177.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -89.96 123.8 34.19 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 175.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.492 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 98.01 37.5 4.38 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.754 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.558 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 67.4 mm-40 -116.61 175.75 5.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 111.74 -174.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HG2' ' CD2' ' A' ' 19' ' ' TYR . 52.9 mtpt -124.44 123.57 40.44 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.182 177.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.5 pt -135.41 153.76 34.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.622 0.725 . . . . 0.0 112.294 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HE2' ' HB3' ' A' ' 15' ' ' SER . 56.0 tttm -110.39 106.52 15.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.588 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 26.7 m -94.56 154.29 3.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.148 0.499 . . . . 0.0 112.179 -172.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.7 m0 -118.47 104.13 10.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.455 175.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.491 ' HB3' HG22 ' A' ' 94' ' ' ILE . 53.1 p90 -117.67 145.48 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.08 0.467 . . . . 0.0 110.637 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -99.29 -39.19 8.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.4 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 38.4 m -120.34 124.32 45.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.274 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -117.85 118.69 32.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.822 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -117.84 115.86 25.82 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.084 0.468 . . . . 0.0 109.76 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 36.2 mt-10 -87.95 85.61 7.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.286 0.565 . . . . 0.0 110.544 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 m -91.23 -6.62 53.08 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.633 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.1 t30 66.68 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.538 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -75.01 156.35 99.91 Favored 'Cis proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.375 -1.51 . . . . 0.0 112.641 -0.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.538 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.3 Cg_exo -61.28 141.2 92.2 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.914 2.409 . . . . 0.0 112.686 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.9 t -132.29 141.51 49.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.863 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -138.32 130.78 29.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.668 0.27 . . . . 0.0 110.775 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.6 m -83.68 119.76 25.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.491 HG22 ' HB3' ' A' ' 81' ' ' PHE . 44.9 pt -102.66 150.4 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.85 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.66 -48.96 4.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.101 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -140.67 169.7 17.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.457 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -155.72 158.11 37.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 0.0 110.895 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.511 ' HB2' ' HB3' ' A' ' 78' ' ' LYS . 43.1 mt-10 -114.57 121.76 44.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.269 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 tp -72.9 121.48 20.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 121.049 0.452 . . . . 0.0 110.49 -177.168 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.473 ' HE3' ' HB3' ' A' ' 80' ' ' TRP . 75.2 mtp . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -90.74 130.24 36.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.791 0.329 . . . . 0.0 111.177 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -79.34 129.12 34.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.905 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.431 HD23 HG22 ' A' ' 32' ' ' THR . 1.5 tt -128.46 116.88 20.39 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.2 t -98.79 122.59 50.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 155.97 26.65 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.38 -178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.438 ' O ' ' HA ' ' A' ' 30' ' ' LEU . 83.7 m-85 -83.99 127.87 34.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.675 0.274 . . . . 0.0 111.012 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.1 t -81.25 96.49 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.0 m -97.02 -36.92 6.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.858 0.361 . . . . 0.0 111.257 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.652 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 81.1 mt -140.25 147.15 39.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -135.94 140.9 44.36 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.4 -177.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 34.8 t70 -121.0 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.451 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 46.9 t30 -82.32 -33.88 28.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.461 . . . . 0.0 110.169 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -95.3 -33.16 12.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.848 -177.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -139.31 164.92 28.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.918 0.39 . . . . 0.0 111.35 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.519 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -129.72 133.79 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.978 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.758 HG22 HD12 ' A' ' 57' ' ' ILE . 71.0 mt -90.65 107.04 18.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.026 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.438 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 40.6 mt -112.83 136.81 52.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.619 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.4 mt -95.33 120.04 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.431 HG22 HD23 ' A' ' 16' ' ' LEU . 20.6 p -90.25 22.89 3.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.969 -175.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -97.31 -167.07 1.48 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.266 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -99.26 -23.44 15.19 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.222 0.534 . . . . 0.0 110.707 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -87.1 140.02 29.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.923 -177.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -98.84 130.98 26.46 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 168.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.465 ' HB3' ' CB ' ' A' ' 41' ' ' ASP . 57.3 Cg_exo -53.76 150.11 30.47 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.959 2.439 . . . . 0.0 112.876 -177.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.72 -171.54 35.94 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.635 -0.793 . . . . 0.0 111.996 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.06 -42.88 77.3 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 122.614 0.366 . . . . 0.0 110.843 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.625 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.8 mt-10 -65.4 -41.22 93.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.944 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.465 ' CB ' ' HB3' ' A' ' 37' ' ' PRO . 16.0 m-20 -65.07 -44.74 87.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.414 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -68.96 -19.08 64.16 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.863 0.363 . . . . 0.0 111.201 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.84 -23.68 23.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.547 -178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.625 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.0 mt -69.03 158.69 34.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.136 178.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -70.78 149.08 47.23 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -59.99 -31.64 70.11 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -172.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.01 -37.83 93.53 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.118 177.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 96.8 mt-30 -66.72 -49.04 67.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 177.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.83 -40.91 96.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.413 178.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 45.7 ttm -61.54 -33.77 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.785 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -81.19 -28.69 34.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.857 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 58.2 mtpt -64.18 -39.14 93.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.094 0.473 . . . . 0.0 110.291 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -113.46 43.39 1.77 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.64 178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -48.3 -37.71 17.07 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -116.72 13.53 15.16 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.346 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -121.91 25.13 9.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.352 0.596 . . . . 0.0 109.491 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.758 HD12 HG22 ' A' ' 29' ' ' ILE . 10.2 tt -130.14 139.12 52.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.688 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.7 t -127.76 123.81 61.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 91' ' ' SER . 58.6 mt -94.83 103.06 14.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.459 HG11 ' HB1' ' A' ' 92' ' ' ALA . 29.1 m -84.1 144.77 9.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.048 0.451 . . . . 0.0 111.329 -175.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.19 122.57 6.36 Favored Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.649 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.519 HD11 ' HB1' ' A' ' 28' ' ' ALA . 63.4 mt -95.25 -4.03 46.47 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.778 0.34 . . . . 0.0 110.536 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 m -59.26 -24.68 63.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.489 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -76.69 -38.58 54.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.49 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.9 mt -106.68 100.14 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.996 0.427 . . . . 0.0 110.887 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -80.23 8.36 7.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.148 0.499 . . . . 0.0 110.7 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -104.02 12.51 34.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.838 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.5 HG21 HD21 ' A' ' 62' ' ' LEU . 5.3 p -81.84 26.03 0.52 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -70.2 -36.63 74.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.868 0.366 . . . . 0.0 111.301 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.63 6.05 29.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.252 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.505 HD13 HD11 ' A' ' 77' ' ' ILE . 14.3 tp -71.54 115.83 11.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.944 0.402 . . . . 0.0 110.079 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 43.3 tttm -100.9 140.86 34.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.512 -174.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 74.1 mtt180 -72.78 152.53 41.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.283 173.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.29 41.39 38.24 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.696 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -143.24 -166.05 2.22 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.497 ' HG3' ' HB2' ' A' ' 100' ' ' LEU . 63.1 pttt -144.28 145.45 32.03 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' A' ' 99' ' ' LEU . 25.5 pt -135.47 152.08 31.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.268 0.556 . . . . 0.0 111.313 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -104.8 106.71 17.32 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.844 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 30.7 m -103.92 155.58 5.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.881 0.372 . . . . 0.0 111.434 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.473 ' HB3' ' HE3' ' A' ' 13' ' ' MET . 6.6 m-90 -113.43 111.59 22.21 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.432 172.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 2.4 p90 -115.43 163.66 15.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.36 -175.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.34 -60.84 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -93.45 133.4 36.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.152 0.501 . . . . 0.0 111.547 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -115.91 117.11 29.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.365 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.716 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 67.2 mttm -85.97 135.28 33.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.962 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -92.6 42.52 1.1 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.995 -173.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.9 t -68.65 -31.84 71.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.843 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 48.6 t30 64.39 102.38 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.428 0 O-C-N 123.611 0.569 . . . . 0.0 110.705 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.403 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 27.2 Cg_exo -63.18 152.12 69.66 Favored 'Cis proline' 0 C--N 1.347 0.452 0 C-N-CA 124.076 -1.218 . . . . 0.0 113.022 2.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 45.6 Cg_exo -55.95 130.1 38.52 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.015 2.477 . . . . 0.0 112.275 -178.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.716 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 13.3 m -105.44 116.06 31.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.082 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.459 ' HB1' HG11 ' A' ' 60' ' ' VAL . . . -104.09 116.05 31.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.731 0.3 . . . . 0.0 111.215 -176.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.1 m -76.88 114.6 15.84 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.9 pt -96.65 139.04 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.915 0.388 . . . . 0.0 111.192 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -104.81 -25.87 12.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.786 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -147.72 163.64 36.06 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.639 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 2.6 p90 -162.01 150.35 15.0 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.989 0.423 . . . . 0.0 111.572 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -114.75 123.09 48.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.763 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.519 ' HA ' HG21 ' A' ' 77' ' ' ILE . 43.7 tp -75.32 110.97 10.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.088 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.497 ' HB2' ' HG3' ' A' ' 76' ' ' LYS . 86.3 mt . . . . . 0 C--N 1.326 -0.44 0 CA-C-O 121.105 0.479 . . . . 0.0 110.679 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.471 ' HB2' ' HB3' ' A' ' 80' ' ' TRP . 61.5 mtm . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.945 0.402 . . . . 0.0 111.594 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -83.2 126.81 33.04 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.675 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.2 m -91.61 132.12 36.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.891 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 32' ' ' THR . 0.2 OUTLIER -137.26 130.3 30.68 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.399 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.22 126.41 52.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.68 169.15 29.23 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.218 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.48 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 87.7 m-85 -103.25 135.51 44.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.849 0.357 . . . . 0.0 110.769 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.77 96.18 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.046 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.5 t -96.11 -53.32 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.608 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.825 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 92.8 mt -116.5 136.19 53.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.977 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -126.88 130.18 49.67 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.209 0.528 . . . . 0.0 111.01 -178.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.38 175.53 5.47 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -74.49 -34.33 63.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -119.23 -0.32 11.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.579 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -143.18 165.29 27.84 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 -175.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.418 ' HB3' ' CG2' ' A' ' 60' ' ' VAL . . . -138.89 122.31 17.21 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.859 0.362 . . . . 0.0 110.074 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.825 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 53.6 mt -90.9 99.33 9.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.243 0.544 . . . . 0.0 109.637 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.7 mt -108.94 139.08 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.711 -173.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.3 mt -87.67 114.21 26.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.445 HG22 HD11 ' A' ' 16' ' ' LEU . 6.0 p -80.08 -16.19 55.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.05 119.42 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.447 HG23 ' HE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -80.56 69.85 7.15 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -171.186 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -128.99 120.31 25.82 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 168.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -67.15 114.12 16.87 Favored Pre-proline 0 C--N 1.327 -0.377 0 O-C-N 123.109 0.256 . . . . 0.0 110.799 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 11.4 Cg_exo -70.92 156.99 59.34 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 123.016 2.477 . . . . 0.0 112.158 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.22 -178.09 34.46 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.769 178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -58.25 -38.51 77.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.905 0.383 . . . . 0.0 110.746 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.6 mp0 -60.93 -40.44 93.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.474 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -72.92 -34.73 66.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.542 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -72.9 -20.08 61.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.613 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -82.1 -26.14 33.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.032 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.0 mt -61.96 145.17 53.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.5 m -88.32 -179.83 6.2 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.999 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.48 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 23.7 mp0 -54.24 -61.48 2.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.57 -172.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.23 -34.2 83.43 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.536 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.38 -41.26 89.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.838 0.352 . . . . 0.0 110.287 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.2 -33.36 65.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.657 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.566 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 66.1 mtt -64.4 -24.42 67.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.415 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -90.35 -31.5 16.87 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.5 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -78.37 -38.9 40.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.184 0.516 . . . . 0.0 110.261 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -113.59 55.39 0.72 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 50' ' ' MET . 20.8 tttt -61.38 112.67 2.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.469 -171.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 65.45 11.68 7.56 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.786 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -107.9 9.08 28.82 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.771 0.796 . . . . 0.0 109.199 174.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.548 HD11 HG22 ' A' ' 29' ' ' ILE . 18.8 tt -123.99 132.52 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.117 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.496 HG23 ' HB2' ' A' ' 90' ' ' PRO . 98.7 t -120.07 125.85 74.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.994 0.426 . . . . 0.0 110.981 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.426 HD12 ' HE2' ' A' ' 50' ' ' MET . 56.4 mt -91.85 96.43 6.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.418 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.0 m -76.01 147.54 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.211 0.529 . . . . 0.0 110.704 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.87 119.87 6.14 Favored Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.769 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.501 HD12 HG21 ' A' ' 68' ' ' THR . 64.6 mt -89.1 27.08 1.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -38.25 80.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.371 -176.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.691 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 26.0 mm-40 -92.72 -9.38 40.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.687 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.408 HD11 ' CD1' ' A' ' 97' ' ' TYR . 50.2 mt -117.36 104.64 16.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.044 0.449 . . . . 0.0 111.008 -175.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -82.23 -38.59 24.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.731 -178.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -81.01 47.99 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.446 0.641 . . . . 0.0 111.252 -175.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.501 HG21 HD12 ' A' ' 62' ' ' LEU . 2.2 p -85.36 18.39 2.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.573 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -73.99 -24.74 59.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.576 174.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.14 -26.33 65.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.928 174.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -83.42 121.48 27.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.494 ' HZ1' ' HB2' ' A' ' 72' ' ' LYS . 9.1 mtmp? -119.29 165.53 14.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.903 0.382 . . . . 0.0 110.821 -179.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -83.76 127.42 33.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.81 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.74 42.48 2.47 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.068 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -134.06 -171.15 2.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.177 0.513 . . . . 0.0 111.455 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.48 ' HD2' ' CE2' ' A' ' 19' ' ' TYR . 83.6 tttt -138.69 129.52 26.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.107 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 pt -136.74 166.65 25.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.663 0.744 . . . . 0.0 112.586 -175.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.498 ' HB2' HD11 ' A' ' 100' ' ' LEU . 55.8 tttt -122.56 106.98 11.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.309 177.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.497 ' HB ' HG22 ' A' ' 94' ' ' ILE . 30.1 m -98.41 149.34 5.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 120.988 0.423 . . . . 0.0 112.139 -171.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 13' ' ' MET . 5.6 m-90 -114.53 106.23 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.393 172.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.437 ' HB3' HG21 ' A' ' 94' ' ' ILE . 30.8 p90 -108.97 135.31 50.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.32 0.581 . . . . 0.0 111.106 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -91.61 -48.9 6.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.449 ' CG2' ' HB ' ' A' ' 93' ' ' THR . 8.6 t -104.68 126.64 51.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.281 0.562 . . . . 0.0 110.243 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -112.39 138.46 49.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.164 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.655 ' HB2' ' HB3' ' A' ' 91' ' ' SER . 58.9 mttm -118.04 134.28 55.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.0 0.428 . . . . 0.0 110.379 -178.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -110.02 56.5 0.62 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.485 0.659 . . . . 0.0 109.544 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 p -73.23 -23.36 60.35 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.53 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 63.87 99.78 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.629 0 C-N-CA 123.252 0.621 . . . . 0.0 111.293 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 34.0 Cg_endo -63.73 147.22 63.4 Favored 'Cis proline' 0 C--N 1.349 0.564 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.585 1.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.496 ' HB2' HG23 ' A' ' 58' ' ' VAL . 34.8 Cg_exo -57.14 152.67 43.45 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.03 2.486 . . . . 0.0 113.082 -176.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.655 ' HB3' ' HB2' ' A' ' 85' ' ' LYS . 26.3 t -134.81 161.06 36.26 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.357 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.26 110.08 2.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.618 0.246 . . . . 0.0 110.599 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.449 ' HB ' ' CG2' ' A' ' 83' ' ' THR . 38.5 m -73.89 113.64 11.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.912 0.387 . . . . 0.0 110.09 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.497 HG22 ' HB ' ' A' ' 79' ' ' VAL . 31.8 pt -100.03 138.4 24.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.008 -177.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.691 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 39.7 mt-30 -104.85 -10.87 17.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.246 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -159.74 144.16 14.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.491 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.408 ' CD1' HD11 ' A' ' 65' ' ' ILE . 5.1 p90 -147.59 152.73 38.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.015 0.435 . . . . 0.0 111.12 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -114.56 144.17 43.81 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.092 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 51.2 tp -93.25 136.62 33.35 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 -178.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.6 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 120.772 0.32 . . . . 0.0 110.182 178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.455 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 67.5 mtm . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -83.85 125.89 32.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.707 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.5 t -109.55 141.16 42.44 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.378 -173.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 78' ' ' LYS . 67.9 mt -139.41 146.82 40.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.276 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.7 t -97.08 127.96 48.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 171.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 157.47 27.31 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.819 -176.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -94.66 125.51 39.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.465 -0.368 . . . . 0.0 110.308 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.51 104.73 11.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.452 HG11 HD21 ' A' ' 49' ' ' LEU . 7.1 p -100.66 -42.04 9.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.861 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.725 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 66.8 mt -129.34 154.81 46.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.644 0.259 . . . . 0.0 110.42 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -148.44 142.11 25.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.09 0.471 . . . . 0.0 111.171 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 13.8 t70 -123.14 -155.72 0.67 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 171.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.458 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 6.9 t30 -102.76 -31.3 10.39 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -91.66 -35.61 14.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.92 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -135.88 165.64 25.16 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.171 -174.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.37 149.69 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.751 174.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.725 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 42.0 mt -106.41 111.55 35.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.957 0.408 . . . . 0.0 110.488 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.76 141.94 44.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.462 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.3 mt -106.71 118.79 55.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.3 p -79.65 120.66 24.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.231 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 60.82 -162.43 0.27 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.665 0.603 . . . . 0.0 110.379 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m 76.94 14.26 2.06 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.314 174.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 62.96 -174.62 0.15 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.356 -178.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.414 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -84.09 135.42 42.12 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.292 178.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 32.2 Cg_exo -58.9 158.47 24.76 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.903 2.402 . . . . 0.0 112.452 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.5 174.08 55.15 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.266 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -62.07 -39.84 93.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.9 mp0 -65.05 -34.14 77.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.326 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -64.64 -36.6 84.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.698 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -75.57 -5.02 43.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.02 0.438 . . . . 0.0 111.042 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.415 HD21 ' HA ' ' A' ' 43' ' ' ASN . 10.3 m120 -109.16 -8.24 15.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.65 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.1 mt -76.34 148.48 37.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 175.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -75.69 165.05 25.63 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.669 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -55.09 -47.45 74.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.537 -173.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.02 93.73 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.608 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.86 -44.82 96.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 0.0 110.624 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.452 HD21 HG11 ' A' ' 21' ' ' VAL . 25.1 tp -62.78 -43.94 97.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.724 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.3 mtp -64.68 -22.98 67.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.428 -179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -93.49 -9.56 37.98 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.54 -50.7 5.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.998 0.427 . . . . 0.0 110.339 179.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -102.55 40.07 1.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -57.83 -29.78 65.21 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.897 -169.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -93.94 -23.76 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -109.41 11.42 25.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.745 0.307 . . . . 0.0 111.615 -175.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.7 tt -91.65 125.04 44.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.3 0.571 . . . . 0.0 110.722 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.0 t -118.84 120.43 64.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.942 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 91' ' ' SER . 66.1 mt -92.43 101.88 13.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -86.22 140.1 16.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.226 0.536 . . . . 0.0 111.236 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -92.17 125.89 8.28 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.292 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.471 HD21 HG22 ' A' ' 68' ' ' THR . 63.2 mt -94.44 14.43 20.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.091 0.472 . . . . 0.0 110.531 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -60.08 -28.46 67.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.845 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 17.3 mm-40 -89.39 -3.44 58.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.442 -176.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.5 mt -119.58 117.67 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.105 0.479 . . . . 0.0 110.249 -177.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -86.12 7.83 23.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.403 0.621 . . . . 0.0 111.136 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -153.94 83.77 1.15 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.168 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.471 HG22 HD21 ' A' ' 62' ' ' LEU . 1.2 p -119.77 13.16 12.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.445 0.64 . . . . 0.0 110.614 177.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -72.98 -9.12 58.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.764 -175.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -92.68 5.86 49.51 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.081 -0.387 . . . . 0.0 111.049 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.7 tp -90.57 140.85 29.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.221 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.478 ' HD3' ' CD ' ' A' ' 75' ' ' GLU . 6.6 mptt -124.58 -178.52 4.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -93.17 123.23 36.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.052 174.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.61 42.69 2.11 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.556 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.478 ' CD ' ' HD3' ' A' ' 72' ' ' LYS . 53.9 mt-10 -128.3 177.84 6.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.896 0.379 . . . . 0.0 110.947 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -121.05 135.19 55.25 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.446 HG21 ' HA ' ' A' ' 99' ' ' LEU . 33.2 pt -137.62 152.99 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.334 0.588 . . . . 0.0 111.483 177.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 82.8 tttt -110.2 107.28 17.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.605 176.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.707 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.3 m -95.17 154.65 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -170.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.455 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 12.7 m-90 -125.78 123.38 38.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.636 172.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.498 ' HB3' HG21 ' A' ' 94' ' ' ILE . 55.5 p90 -140.07 171.35 14.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.003 0.43 . . . . 0.0 111.089 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 62.8 t60 -147.27 -35.8 0.23 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.494 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.586 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 2.5 m -76.47 98.78 4.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.063 175.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.0 ttt180 -94.73 120.95 35.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.406 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -119.8 139.35 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -121.57 101.62 7.72 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.464 -0.495 . . . . 0.0 110.864 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.5 t -104.8 -11.66 16.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.311 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 65.65 99.51 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 O-C-N 124.078 0.861 . . . . 0.0 109.675 -174.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -72.28 171.4 63.33 Favored 'Cis proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.004 -1.248 . . . . 0.0 113.227 3.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.73 140.61 84.7 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.02 2.48 . . . . 0.0 112.798 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.8 p -130.04 115.75 17.56 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.417 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.4 125.05 50.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.764 0.316 . . . . 0.0 110.884 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.586 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 24.3 m -84.62 107.56 16.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' A' ' 81' ' ' PHE . 31.0 pt -96.44 139.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.113 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -103.14 -5.32 23.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.539 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -173.26 151.34 2.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.734 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -143.84 163.4 33.49 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.61 120.99 42.06 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.446 ' HA ' HG21 ' A' ' 77' ' ' ILE . 37.0 tp -75.24 109.71 8.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.961 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 43.5 mt . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 121.066 0.46 . . . . 0.0 110.533 -176.564 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.506 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 53.1 mtp . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.885 0.374 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 13.4 mp0 -83.79 161.63 20.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.055 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 m -102.85 128.66 49.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 0.0 111.45 -175.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.612 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 4.7 tt -116.7 109.5 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.8 t -93.9 117.78 38.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 158.69 27.77 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.473 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -96.25 127.82 42.61 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.0 t -75.92 97.3 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -103.4 -37.5 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -176.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.725 HD22 HD12 ' A' ' 29' ' ' ILE . 36.8 tp -136.26 126.69 26.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.512 ' HE3' ' HB2' ' A' ' 71' ' ' LEU . 62.4 tttm -146.46 125.54 12.88 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.664 -177.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -70.41 0.57 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.106 0.479 . . . . 0.0 110.245 176.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -154.68 -60.59 0.12 Allowed 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -97.61 -20.2 17.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.928 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 27' ' ' ARG . 19.8 mtm180 -104.13 123.88 48.08 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.967 0.413 . . . . 0.0 110.954 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.497 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -111.05 112.92 25.08 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.956 176.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.725 HD12 HD22 ' A' ' 22' ' ' LEU . 54.1 mt -86.03 109.46 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.473 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.22 143.01 42.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.688 -175.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.9 mt -104.97 123.0 58.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -76.78 101.23 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.548 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.3 t70 64.28 101.77 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.812 0.695 . . . . 0.0 111.364 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.15 -7.24 4.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.36 40.2 29.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -174.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.25 102.84 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.289 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.503 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -50.72 -63.52 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.186 2.591 . . . . 0.0 112.849 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.7 148.69 5.44 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.757 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -61.21 -37.71 83.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.477 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.8 -26.64 44.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.5 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.541 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 2.3 m-20 -65.41 -32.2 73.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.762 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -69.66 -14.19 62.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.918 0.389 . . . . 0.0 110.63 176.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -99.6 -18.07 17.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' ' HA ' ' A' ' 41' ' ' ASP . 87.6 mt -63.26 149.91 44.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.029 0.442 . . . . 0.0 110.989 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -76.25 171.26 14.83 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.871 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 50' ' ' MET . 41.9 tt0 -56.27 -54.62 43.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.346 -176.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.03 -37.5 91.67 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.469 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -65.28 -43.37 91.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.984 0.421 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.5 mt -68.23 -40.02 82.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.948 177.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.436 ' HE2' ' HG3' ' A' ' 89' ' ' PRO . 85.5 mtp -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.998 -177.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.59 -34.12 14.15 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.974 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -76.66 -43.9 36.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.057 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -110.09 39.82 2.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.871 0.844 . . . . 0.0 109.107 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.411 ' O ' HG21 ' A' ' 57' ' ' ILE . 26.7 ttpt -53.93 -48.64 70.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.723 -170.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -86.51 0.52 54.1 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -175.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -124.98 17.99 8.5 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.709 -176.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.417 HG23 ' HB3' ' A' ' 89' ' ' PRO . 13.6 tt -103.36 124.14 57.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.193 0.521 . . . . 0.0 111.74 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.504 HG21 ' HG2' ' A' ' 90' ' ' PRO . 70.1 t -124.33 137.54 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.301 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.66 HD13 HG12 ' A' ' 29' ' ' ILE . 13.3 mm -104.2 100.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.142 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' A' ' 28' ' ' ALA . 34.3 m -89.01 139.95 16.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.257 0.551 . . . . 0.0 111.046 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -94.36 117.2 5.47 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.948 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.526 ' HB3' HG22 ' A' ' 68' ' ' THR . 49.0 mt -95.75 11.03 34.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.626 0.37 . . . . 0.0 110.562 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.1 m -63.93 -14.83 56.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.45 ' OE2' ' HG2' ' A' ' 95' ' ' GLN . 27.5 tt0 -96.72 -3.33 42.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.21 0.529 . . . . 0.0 110.418 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.45 ' CG2' HG23 ' A' ' 68' ' ' THR . 31.1 mt -113.23 109.92 30.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.91 11.36 9.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.814 -168.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -136.9 24.01 3.07 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 122.207 -0.308 . . . . 0.0 111.763 -177.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.526 HG22 ' HB3' ' A' ' 62' ' ' LEU . 1.7 p -80.43 37.73 0.41 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.78 -21.22 25.24 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.046 0.451 . . . . 0.0 110.623 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -73.95 -17.73 60.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.976 -174.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.512 ' HB2' ' HE3' ' A' ' 23' ' ' LYS . 3.2 mm? -71.31 122.79 20.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.745 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -108.01 171.19 7.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.424 -179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -86.4 117.9 25.5 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.43 33.56 2.68 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.759 -177.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.63 -177.48 4.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -135.13 135.0 40.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 -175.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.515 HG22 ' HA ' ' A' ' 99' ' ' LEU . 32.1 pt -137.93 151.45 25.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.432 0.634 . . . . 0.0 111.7 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.432 ' HD3' ' OE2' ' A' ' 98' ' ' GLU . 47.9 tttm -115.33 106.75 14.38 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.541 172.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.432 ' CG2' ' HB3' ' A' ' 16' ' ' LEU . 30.1 m -100.77 154.15 4.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.323 -174.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.2 m-90 -104.81 119.46 39.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.642 174.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.612 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -136.79 171.99 13.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -164.57 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.465 -0.789 . . . . 0.0 108.892 175.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.405 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 0.2 OUTLIER -75.3 90.68 2.63 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.991 174.506 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 84' ' ' ARG . 23.0 ttt180 -108.45 117.84 35.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.131 0.491 . . . . 0.0 110.787 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -112.47 94.51 4.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.399 -0.819 . . . . 0.0 108.839 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.794 ' HG3' ' HB3' ' A' ' 90' ' ' PRO . 27.3 tt0 -85.47 109.71 18.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.362 0.601 . . . . 0.0 111.283 -173.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p -108.68 -11.63 15.05 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.583 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.0 t30 62.01 96.18 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.354 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.433 -173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.436 ' HG3' ' HE2' ' A' ' 50' ' ' MET . 39.4 Cg_endo -66.63 144.1 66.91 Favored 'Cis proline' 0 C--N 1.344 0.317 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.677 1.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.794 ' HB3' ' HG3' ' A' ' 86' ' ' GLU . 41.4 Cg_endo -68.7 139.87 45.3 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.715 2.277 . . . . 0.0 112.656 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 29.8 t -111.28 153.45 25.9 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.21 131.18 19.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.682 0.277 . . . . 0.0 111.074 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.405 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 11.9 m -85.91 126.89 34.43 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG21 ' HB3' ' A' ' 81' ' ' PHE . 31.3 pt -117.47 153.04 19.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.519 -178.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.473 ' HB2' ' HE1' ' A' ' 13' ' ' MET . 80.0 mt-30 -110.6 -38.17 5.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.035 176.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -130.8 150.91 51.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.736 -172.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 1.7 p90 -152.07 154.1 35.27 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 0.0 110.712 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.432 ' OE2' ' HD3' ' A' ' 78' ' ' LYS . 42.0 mt-10 -117.21 114.34 23.51 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.502 175.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.515 ' HA ' HG22 ' A' ' 77' ' ' ILE . 65.1 tp -71.38 104.41 3.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 78' ' ' LYS . 73.1 mt . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.491 ' HE1' ' HB3' ' A' ' 80' ' ' TRP . 69.3 mtp . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -83.84 119.56 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.321 -177.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.9 t -83.59 109.89 17.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 -178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.484 HD11 HG21 ' A' ' 32' ' ' THR . 3.2 tm? -116.52 119.31 35.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.693 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.443 HG21 ' HG3' ' A' ' 78' ' ' LYS . 30.5 t -94.08 129.65 44.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 162.8 28.93 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.656 -176.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -100.89 126.46 47.51 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.71 91.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.705 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.465 HG22 ' CE1' ' A' ' 42' ' ' TYR . 2.9 p -93.15 -39.48 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.674 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.727 HD21 HD13 ' A' ' 29' ' ' ILE . 39.8 tp -130.27 133.01 46.18 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -131.37 137.47 48.74 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.827 0.346 . . . . 0.0 110.338 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.16 -176.98 3.24 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.22 -37.68 52.84 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -94.54 -37.31 11.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.782 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -137.56 174.75 10.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.983 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -145.89 149.24 33.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.511 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.727 HD13 HD21 ' A' ' 22' ' ' LEU . 42.3 mt -106.25 115.92 48.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.078 178.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.0 mt -110.09 138.48 46.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.404 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.8 mt -95.21 118.51 41.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.484 HG21 HD11 ' A' ' 16' ' ' LEU . 14.5 p -79.93 89.7 5.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.226 -174.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.49 ' C ' ' HG1' ' A' ' 34' ' ' THR . 38.5 t70 55.5 86.91 0.05 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.442 171.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.49 ' HG1' ' C ' ' A' ' 33' ' ' ASP . 2.9 m -148.44 31.63 0.81 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.521 0.677 . . . . 0.0 110.064 178.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 63.91 28.05 14.5 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.269 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.44 150.9 0.11 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.67 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 95.3 Cg_endo -81.26 161.41 20.17 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.205 1.937 . . . . 0.0 111.559 173.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.86 173.29 30.52 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.145 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -58.78 -28.43 65.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.278 0.561 . . . . 0.0 109.714 177.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.59 -38.85 75.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.89 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.459 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 54.6 m-20 -81.17 -28.34 35.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.37 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CE1' HG22 ' A' ' 21' ' ' VAL . 91.7 m-85 -74.02 -18.88 60.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.129 0.49 . . . . 0.0 109.841 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -80.43 -37.21 32.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.177 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.401 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 78.8 mt -64.1 162.0 15.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.27 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.9 m -81.54 162.97 22.97 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -32.96 72.52 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.292 -173.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.78 -41.55 93.58 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.14 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.401 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 93.7 mt-30 -66.73 -38.01 85.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 110.193 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.8 tp -68.66 -40.66 80.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.008 175.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.524 ' HG3' HD13 ' A' ' 57' ' ' ILE . 47.9 ttm -61.54 -29.42 69.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -81.74 -35.14 30.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.97 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -71.98 -52.26 17.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.919 0.39 . . . . 0.0 110.683 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -95.35 46.39 1.11 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.515 0.674 . . . . 0.0 109.321 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.1 tttp -53.37 -35.08 59.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.362 -1.29 . . . . 0.0 113.247 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -109.04 1.31 20.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -120.71 7.16 10.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.608 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.524 HD13 ' HG3' ' A' ' 50' ' ' MET . 10.9 tt -93.43 123.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.968 -179.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.25 129.36 73.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.281 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.421 HG12 HG12 ' A' ' 29' ' ' ILE . 59.7 mt -95.57 108.2 20.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.834 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.77 142.98 12.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.262 0.553 . . . . 0.0 111.326 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.31 115.99 4.51 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.816 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.485 HD22 HG21 ' A' ' 68' ' ' THR . 69.8 mt -105.18 -4.8 21.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.735 0.303 . . . . 0.0 110.665 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.5 m -62.98 -29.21 70.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.321 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -90.65 9.56 29.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.121 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.45 HD12 HG13 ' A' ' 94' ' ' ILE . 58.2 mt -137.72 95.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 174.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -75.16 -9.66 58.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -176.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -89.81 33.5 0.85 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.641 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.485 HG21 HD22 ' A' ' 62' ' ' LEU . 8.0 p -101.93 21.17 15.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.131 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -80.6 -31.26 36.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.522 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -74.16 -10.57 59.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.583 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.4 tp -71.87 119.82 16.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.919 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -99.39 144.46 28.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.507 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -77.63 133.01 38.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.75 48.29 3.7 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -175.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.434 ' HG2' HD11 ' A' ' 99' ' ' LEU . 6.0 tp10 -140.98 171.44 14.07 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -116.19 139.19 50.6 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' A' ' 99' ' ' LEU . 33.1 pt -139.36 154.68 25.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.27 0.557 . . . . 0.0 111.587 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HG3' HG21 ' A' ' 17' ' ' VAL . 38.4 ttpt -116.58 107.0 14.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.168 -0.923 . . . . 0.0 108.899 174.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.499 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 25.3 m -96.85 158.96 3.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.042 0.449 . . . . 0.0 111.59 -173.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.491 ' HB3' ' HE1' ' A' ' 13' ' ' MET . 3.3 m-90 -126.39 122.02 34.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.225 173.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -133.28 158.1 43.78 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.183 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -112.72 -12.19 13.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.06 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.9 m -141.11 137.18 32.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.165 -176.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.2 mtm-85 -112.38 140.48 47.06 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 174.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 91' ' ' SER . 82.6 tttt -84.44 117.68 23.8 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 104.43 1.72 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.362 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.8 p -162.09 176.36 10.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.356 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -134.17 110.57 11.79 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.698 175.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.36 156.25 96.84 Favored 'Cis proline' 0 C--O 1.235 0.368 0 C-N-CA 123.772 -1.345 . . . . 0.0 112.609 -0.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.7 138.79 87.7 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.703 2.268 . . . . 0.0 112.149 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 21.6 m -112.54 158.32 20.08 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.273 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -150.79 101.38 2.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.887 0.375 . . . . 0.0 111.289 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 27.4 m -71.19 115.54 10.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.45 HG13 HD12 ' A' ' 65' ' ' ILE . 37.7 pt -89.8 154.24 3.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.261 0.553 . . . . 0.0 111.736 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -104.76 -23.0 13.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.203 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 97' ' ' TYR . 51.6 tttt -162.32 159.56 25.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.318 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.499 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 30.2 p90 -148.89 157.67 43.6 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 175.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -114.48 116.25 28.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.74 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . 0.519 ' HA ' HG21 ' A' ' 77' ' ' ILE . 43.7 tp -72.48 108.76 5.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.937 179.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.287 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.528 ' HE2' ' HD2' ' A' ' 96' ' ' LYS . 61.3 mtm . . . . . 0 CA--C 1.519 -0.228 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -87.14 116.77 25.43 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.623 ' HB3' ' CD1' ' A' ' 80' ' ' TRP . 17.8 p -94.15 133.85 37.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.728 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.75 130.86 38.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.602 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -93.74 133.11 35.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.195 179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -155.66 167.64 33.14 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.301 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -97.0 134.08 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.635 0.255 . . . . 0.0 110.776 178.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.2 t -83.64 106.36 14.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 25.5 m -104.34 -34.8 3.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.882 0.372 . . . . 0.0 111.552 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 84.8 mt -135.82 140.38 44.19 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -136.42 119.26 16.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.431 0.634 . . . . 0.0 111.901 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 18.7 t70 -97.54 176.33 5.9 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 170.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -64.21 -38.77 92.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.653 0.264 . . . . 0.0 110.453 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -107.65 -41.31 5.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.692 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 51.1 mtm-85 -104.2 115.8 31.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.108 0.48 . . . . 0.0 112.215 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.438 ' HB2' HD13 ' A' ' 62' ' ' LEU . . . -100.96 121.97 42.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.873 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 67.6 mt -91.3 110.83 22.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.011 -178.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 mt -109.87 147.34 33.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.749 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.6 mt -104.8 113.34 41.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.149 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -90.65 -19.18 23.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.621 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.539 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 34.2 t70 -65.99 119.49 11.44 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 172.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.5 m -75.85 85.96 2.82 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.788 0.804 . . . . 0.0 112.07 -170.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -140.23 136.58 33.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.592 -1.186 . . . . 0.0 108.635 172.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.13 118.2 65.1 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -78.81 115.61 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.603 2.202 . . . . 0.0 111.431 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 -163.66 25.18 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.774 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.36 -44.17 79.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.547 0.213 . . . . 0.0 111.206 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -67.78 -32.75 73.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.821 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -65.47 -36.76 84.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.125 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -85.72 -6.13 59.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -88.03 -26.49 22.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 110.319 176.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.33 147.54 47.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.212 177.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 57.3 p -75.67 161.53 29.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.348 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -53.17 -41.86 65.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.559 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.11 -53.15 48.1 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.491 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.91 -37.22 86.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.101 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.6 tp -61.23 -44.34 97.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.327 0.584 . . . . 0.0 109.849 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 51.9 ttm -70.86 -20.41 62.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.074 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.31 -38.63 63.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.197 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -79.61 -48.9 13.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.888 0.375 . . . . 0.0 110.94 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -91.27 23.67 3.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.837 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -50.16 -42.26 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -171.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -98.45 12.1 36.1 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.539 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 16.0 t-20 -154.49 34.44 0.41 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.322 0.582 . . . . 0.0 111.19 -177.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.6 tt -119.8 132.43 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.5 t -121.47 125.35 73.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 0.0 111.391 -174.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.8 mt -101.35 114.87 41.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 27.1 m -98.89 145.16 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.187 0.518 . . . . 0.0 111.373 -176.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -95.14 114.22 4.8 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.045 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.53 HD11 ' HB ' ' A' ' 68' ' ' THR . 42.4 mt -87.06 4.77 40.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.048 0.451 . . . . 0.0 109.914 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -56.84 -37.24 70.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.51 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -85.23 -7.21 59.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 0.0 110.997 -178.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.9 mt -94.53 -39.24 10.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.681 176.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 76.08 -37.98 0.32 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.351 172.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -130.27 87.83 2.56 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.385 0.612 . . . . 0.0 109.658 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.53 ' HB ' HD11 ' A' ' 62' ' ' LEU . 4.0 m -119.62 24.58 10.54 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 174.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -18.36 52.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.541 -1.663 . . . . 0.0 113.202 -172.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -66.67 -27.5 67.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.922 0.391 . . . . 0.0 110.606 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.619 HD23 HG23 ' A' ' 77' ' ' ILE . 3.6 mp -73.81 145.29 45.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.342 0.591 . . . . 0.0 111.8 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -119.47 157.88 27.38 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.197 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 73' ' ' ARG . 7.9 ptt180 -76.94 71.7 3.46 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.105 0.955 . . . . 0.0 110.768 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 162.48 48.7 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -138.06 -173.88 3.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.187 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -126.98 124.75 40.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.757 -176.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.619 HG23 HD23 ' A' ' 71' ' ' LEU . 42.8 pt -136.34 166.85 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.644 0.735 . . . . 0.0 112.43 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -131.31 106.94 8.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.46 -1.245 . . . . 0.0 108.562 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.4 m -95.86 150.73 4.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.623 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 5.4 m-90 -116.11 118.31 32.5 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.736 173.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.5 ' HB3' HG23 ' A' ' 94' ' ' ILE . 19.0 p90 -124.77 176.62 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.105 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -93.71 -43.14 8.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.927 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -162.76 177.85 8.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.456 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -123.68 136.0 54.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.914 0.388 . . . . 0.0 111.0 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -99.13 97.65 8.74 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.494 ' HG2' ' HG3' ' A' ' 90' ' ' PRO . 1.5 tm-20 -87.36 87.89 7.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.256 0.551 . . . . 0.0 110.141 -174.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.5 p -108.02 2.89 23.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.251 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 27.1 t-20 60.18 101.11 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.364 -177.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.429 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 73.9 Cg_endo -75.98 152.38 96.6 Favored 'Cis proline' 0 CA--C 1.53 0.325 0 C-N-CA 123.29 -1.546 . . . . 0.0 112.658 -0.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.494 ' HG3' ' HG2' ' A' ' 86' ' ' GLU . 31.9 Cg_exo -59.09 120.54 8.46 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.646 2.231 . . . . 0.0 112.003 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.6 m -105.69 142.69 34.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.635 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.51 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -142.37 121.79 13.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.85 0.357 . . . . 0.0 111.443 -177.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.6 m -81.49 110.05 16.53 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.5 HG23 ' HB3' ' A' ' 81' ' ' PHE . 37.8 pt -96.43 155.49 3.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.608 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.35 -29.43 5.5 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.464 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.528 ' HD2' ' HE2' ' A' ' 13' ' ' MET . 79.2 mttt -135.03 155.17 51.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.885 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -153.7 148.1 26.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.178 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.448 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 34.3 tt0 -114.69 119.71 37.65 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 53.6 tp -78.6 119.5 21.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.504 -177.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 98.1 mt . . . . . 0 C--N 1.321 -0.638 0 CA-C-O 121.132 0.491 . . . . 0.0 110.367 -179.229 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.456 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 75.6 mtm . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -83.63 116.78 22.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -175.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 10.8 t -107.94 139.5 42.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.013 -169.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.424 HD13 ' C ' ' A' ' 15' ' ' SER . 6.0 mp -138.47 163.32 32.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.298 174.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -95.71 140.42 17.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 136.84 6.09 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.055 -1.069 . . . . 0.0 112.468 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -90.25 124.47 34.9 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.966 0.412 . . . . 0.0 110.115 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.475 HG21 HD11 ' A' ' 71' ' ' LEU . 13.9 t -82.01 104.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.983 -177.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.508 HG21 HD21 ' A' ' 49' ' ' LEU . 15.9 m -100.98 -41.28 8.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.177 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.683 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.1 mt -130.23 146.1 51.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 110.515 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -132.85 123.54 26.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.314 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.423 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 67.6 m-20 -101.33 -2.91 29.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 174.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 t30 75.63 -55.59 0.62 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.478 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.71 -18.91 50.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.599 0.714 . . . . 0.0 109.186 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 14.7 mtm180 -135.16 159.74 40.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.802 175.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.508 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -134.75 127.61 31.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.055 0.455 . . . . 0.0 110.518 175.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.683 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 56.9 mt -95.4 101.53 12.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.423 HD23 HG23 ' A' ' 20' ' ' VAL . 32.4 mt -115.05 140.91 48.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.124 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -90.67 111.47 23.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -83.2 -9.34 59.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.306 0.574 . . . . 0.0 110.979 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -90.38 157.58 17.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.324 176.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.9 p -89.53 3.44 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -172.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.42 93.92 4.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 109.898 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.97 128.1 92.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.413 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 96.3 Cg_endo -78.94 -178.93 5.01 Favored 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 123.008 2.472 . . . . 0.0 112.671 -178.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.66 -176.37 20.62 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.521 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -68.38 -23.12 64.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.968 0.414 . . . . 0.0 110.637 -177.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -70.81 -38.41 73.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.377 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 7.8 m-20 -65.17 -38.54 90.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.491 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -65.94 -19.03 65.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.889 0.376 . . . . 0.0 111.018 175.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.43 -20.48 23.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.939 178.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 99.2 mt -74.76 153.37 38.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 177.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.2 p -77.68 168.68 19.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.496 ' HG3' HD12 ' A' ' 22' ' ' LEU . 1.6 mp0 -53.77 -42.65 68.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.77 178.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.53 -49.33 70.24 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.222 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.403 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 77.9 mm-40 -64.11 -43.52 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.928 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 21' ' ' VAL . 29.1 tp -64.31 -47.23 80.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.245 -177.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' HD12 ' A' ' 59' ' ' ILE . 68.3 mtm -75.82 -13.36 60.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.484 -177.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -89.07 -35.44 16.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.086 0.47 . . . . 0.0 110.295 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -73.38 -49.22 28.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.349 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.58 47.12 0.93 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -59.12 121.02 10.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.794 -172.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 69.35 4.83 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.041 -0.981 . . . . 0.0 112.358 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -104.83 5.59 33.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.585 0.707 . . . . 0.0 109.281 173.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.598 HD12 HG21 ' A' ' 29' ' ' ILE . 19.4 tt -126.04 140.14 49.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.697 -176.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -122.53 129.07 75.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.124 0.488 . . . . 0.0 111.086 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.448 HD12 ' SD ' ' A' ' 50' ' ' MET . 60.4 mt -94.91 107.76 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 175.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.472 ' CG2' ' HB2' ' A' ' 28' ' ' ALA . 33.5 m -88.91 145.2 7.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.255 0.55 . . . . 0.0 111.032 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.13 115.19 4.53 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.346 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.512 HD13 HG21 ' A' ' 68' ' ' THR . 87.2 mt -94.98 21.48 7.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.005 0.431 . . . . 0.0 110.307 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 27.2 p -60.6 -25.79 66.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.333 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -87.45 -9.31 54.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.011 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.425 HD13 ' HA ' ' A' ' 96' ' ' LYS . 47.7 mt -128.32 105.59 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.23 -177.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -81.66 -11.85 58.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.707 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -116.04 82.07 1.71 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.547 0.689 . . . . 0.0 109.813 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.512 HG21 HD13 ' A' ' 62' ' ' LEU . 38.4 p -111.14 17.68 20.11 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.219 -0.901 . . . . 0.0 108.606 174.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.88 -27.32 69.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.341 -1.3 . . . . 0.0 111.306 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.73 -23.48 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.065 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.475 HD11 HG21 ' A' ' 20' ' ' VAL . 23.9 tp -65.19 131.7 47.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -117.76 172.8 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.228 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 73' ' ' ARG . 23.8 mtm180 -98.0 137.56 36.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.809 0.338 . . . . 0.0 110.31 176.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.33 23.33 22.19 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -116.97 -173.12 2.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.075 0.464 . . . . 0.0 111.404 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.486 ' HG2' HD11 ' A' ' 100' ' ' LEU . 78.3 tttt -141.82 123.21 14.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.972 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 pt -130.98 168.9 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.388 0.613 . . . . 0.0 112.004 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -116.48 117.84 31.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.08 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.564 ' O ' ' HA ' ' A' ' 15' ' ' SER . 26.8 m -104.29 148.69 8.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.505 ' CD1' ' HB2' ' A' ' 15' ' ' SER . 6.8 m-90 -125.67 116.76 22.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.148 175.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.493 ' HB3' HG21 ' A' ' 94' ' ' ILE . 30.1 p90 -126.05 167.6 15.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 0.0 111.886 177.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.71 29.66 2.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.075 177.028 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -172.29 148.22 2.08 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.617 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -149.5 139.39 21.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -113.43 141.67 46.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.141 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.25 47.47 1.34 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.852 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.9 p -64.85 -37.82 88.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 55.57 93.95 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 O-C-N 123.875 0.735 . . . . 0.0 111.764 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 38.7 Cg_exo -60.98 135.38 14.62 Favored 'Cis proline' 0 C--N 1.354 0.824 0 C-N-CA 124.163 -1.182 . . . . 0.0 112.788 3.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 36.9 Cg_exo -59.43 141.45 97.53 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.125 2.55 . . . . 0.0 113.009 -175.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.0 p -116.22 151.09 36.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.89 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.34 119.15 9.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.741 0.305 . . . . 0.0 110.808 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 45.6 m -78.55 110.72 13.9 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.366 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.493 HG21 ' HB3' ' A' ' 81' ' ' PHE . 41.1 pt -96.13 143.76 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.659 -178.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -93.07 -28.81 16.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.615 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.425 ' HA ' HD13 ' A' ' 65' ' ' ILE . 67.8 mttm -150.89 159.58 44.46 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.339 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -147.65 147.6 30.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.595 176.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.498 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 28.0 tt0 -114.42 136.88 52.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.185 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.31 120.83 25.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.486 HD11 ' HG2' ' A' ' 76' ' ' LYS . 92.9 mt . . . . . 0 C--N 1.323 -0.563 0 CA-C-O 121.047 0.451 . . . . 0.0 110.209 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.1 mtp . . . . . 0 N--CA 1.45 -0.449 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.453 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.6 mt-30 -83.66 125.27 31.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.173 0.511 . . . . 0.0 110.442 -171.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.2 m -100.81 134.47 43.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.809 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.509 HD13 ' CE2' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -117.75 124.37 48.3 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 174.297 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.1 t -94.52 117.87 39.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.87 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.61 167.37 29.21 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.85 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.44 146.14 26.66 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.9 t -101.23 108.44 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.44 HG21 ' HG2' ' A' ' 37' ' ' PRO . 47.0 t -101.17 -59.66 3.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.856 0.36 . . . . 0.0 110.821 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.684 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 85.6 mt -116.65 159.51 22.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.405 -175.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -143.95 124.22 13.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.621 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 8.1 t70 -77.92 -66.4 0.85 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.124 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 49.3 t30 163.72 -60.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.662 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -90.62 -17.09 27.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.827 -1.078 . . . . 0.0 109.68 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -124.77 151.07 45.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.493 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.495 ' HB1' HD12 ' A' ' 62' ' ' LEU . . . -122.73 138.61 54.57 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.17 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.684 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 73.3 mt -99.05 104.08 15.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.913 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.8 mt -112.63 156.44 22.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.712 -172.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -106.39 109.0 26.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.229 171.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.0 p -83.84 72.55 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.8 0.809 . . . . 0.0 109.763 177.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' A' ' 34' ' ' THR . 10.2 t70 -157.34 -167.36 2.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.606 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.45 ' H ' ' CG ' ' A' ' 33' ' ' ASP . 6.5 t -110.63 -11.98 14.38 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.952 -178.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.68 132.43 46.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.057 0.456 . . . . 0.0 111.652 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.37 115.87 65.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.265 177.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HG2' HG21 ' A' ' 21' ' ' VAL . 18.1 Cg_exo -66.63 146.17 78.36 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.819 2.346 . . . . 0.0 112.169 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.77 -179.36 31.98 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.667 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.51 -40.07 81.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.849 0.357 . . . . 0.0 110.864 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.53 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.8 tt0 -64.3 -31.57 72.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -72.03 -35.03 69.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.833 0.349 . . . . 0.0 110.363 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.73 -25.07 61.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.063 0.459 . . . . 0.0 109.896 174.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -75.37 -27.91 59.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.139 176.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 95.7 mt -65.96 155.84 35.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.247 176.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.8 p -90.53 174.07 7.73 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.411 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.81 -50.96 55.16 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 123.41 0.444 . . . . 0.0 111.821 -176.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.62 -42.5 99.69 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.619 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -65.71 -39.1 90.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 0.0 110.254 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.31 -44.68 94.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.145 176.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.67 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 76.2 mtp -67.84 -18.35 64.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.967 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -91.56 -21.36 20.89 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.745 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -86.12 -51.32 6.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.328 0.585 . . . . 0.0 109.733 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -96.23 49.64 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.67 ' HA ' ' O ' ' A' ' 50' ' ' MET . 33.6 tttp -53.65 118.21 3.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.522 -170.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 64.89 10.34 6.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.584 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -106.31 15.26 26.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.753 0.787 . . . . 0.0 109.278 175.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.56 HD11 HG21 ' A' ' 29' ' ' ILE . 8.8 tt -107.97 135.53 46.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.335 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 90' ' ' PRO . 74.6 t -126.76 131.66 70.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.854 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 91' ' ' SER . 72.2 mt -97.24 109.14 22.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 175.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 92' ' ' ALA . 29.0 m -93.09 140.99 15.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.295 0.569 . . . . 0.0 111.318 -177.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.63 118.65 5.29 Favored Glycine 0 N--CA 1.442 -0.965 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.36 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD13 HG21 ' A' ' 68' ' ' THR . 11.0 mt -99.26 17.78 19.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.3 p -65.59 -14.23 60.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.685 -176.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -86.45 -12.45 49.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.004 0.43 . . . . 0.0 110.325 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.5 mm -117.65 108.8 25.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.893 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -91.98 16.53 10.92 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.468 0.651 . . . . 0.0 110.004 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -134.22 31.44 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.019 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.498 HG21 HD13 ' A' ' 62' ' ' LEU . 1.7 m -86.45 44.13 1.12 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.378 0.609 . . . . 0.0 111.861 -171.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.57 -23.54 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.543 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -83.58 5.59 23.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.105 0.479 . . . . 0.0 111.074 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.454 HD13 ' CE2' ' A' ' 97' ' ' TYR . 9.9 tt -97.52 115.82 28.55 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -100.18 -172.36 2.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.399 0.618 . . . . 0.0 111.354 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -96.82 141.52 29.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.19 168.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.45 31.27 28.04 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.818 176.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -119.08 -168.01 1.49 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.932 0.396 . . . . 0.0 110.419 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -138.38 134.59 34.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.7 pt -135.63 158.33 39.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 112.421 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -117.64 106.77 13.45 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.932 173.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 19.1 m -100.65 148.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.95 0.405 . . . . 0.0 111.866 -172.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.497 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 7.9 m-90 -106.23 104.92 14.72 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.331 173.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.509 ' CE2' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -107.21 159.08 16.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.057 -177.456 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -112.38 -30.97 6.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.771 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -134.57 127.17 30.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.973 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -119.25 123.61 44.69 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 174.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -125.1 121.03 33.09 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.621 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.79 83.6 7.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.939 0.4 . . . . 0.0 110.313 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -84.24 -13.77 51.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.833 175.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.12 92.72 0.06 OUTLIER Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.151 -178.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -67.96 143.64 69.78 Favored 'Cis proline' 0 C--N 1.346 0.421 0 C-N-CA 123.836 -1.318 . . . . 0.0 112.768 2.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.506 ' HB2' HG21 ' A' ' 58' ' ' VAL . 31.7 Cg_exo -58.22 142.7 97.47 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.715 2.277 . . . . 0.0 112.327 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 15.5 m -122.82 156.63 34.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.637 179.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 60' ' ' VAL . . . -146.47 136.36 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.558 0.218 . . . . 0.0 110.879 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.5 m -94.41 114.7 26.77 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.486 HG21 ' HB3' ' A' ' 81' ' ' PHE . 2.8 pp -104.11 142.0 18.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.782 -177.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -105.22 -9.56 17.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.753 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.27 147.6 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.454 ' CE2' HD13 ' A' ' 71' ' ' LEU . 4.7 p90 -134.07 146.67 50.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 0.0 110.703 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.497 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 33.2 tt0 -116.24 126.45 53.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.812 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 39.6 tp -75.97 135.92 40.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.31 0.576 . . . . 0.0 111.4 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 C--N 1.324 -0.539 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.502 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.497 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 76.7 mtm . . . . . 0 N--CA 1.451 -0.41 0 CA-C-O 120.678 0.275 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -88.56 139.11 30.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.577 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.6 t -88.88 124.5 34.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.963 0.411 . . . . 0.0 110.887 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.36 125.49 42.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.869 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 60.7 t -105.33 120.9 56.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 174.47 28.26 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.432 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -102.07 136.62 41.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.44 HG21 HD21 ' A' ' 30' ' ' LEU . 11.4 t -91.6 102.7 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.725 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 m -100.21 -35.58 4.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.499 -178.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.875 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 70.1 mt -129.72 138.52 51.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -176.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -148.73 127.92 12.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.8 175.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.26 -80.68 0.53 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.773 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -144.4 -66.57 0.34 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -89.94 -18.76 25.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.135 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -119.97 140.21 51.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.492 0.663 . . . . 0.0 112.048 -172.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' A' ' 62' ' ' LEU . . . -121.62 117.74 27.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.156 172.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.875 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 47.5 mt -88.63 105.91 16.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.752 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.44 HD21 HG21 ' A' ' 20' ' ' VAL . 20.8 mt -106.42 157.61 17.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.966 -176.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.9 mt -103.48 120.55 53.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -31.81 68.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.195 0.521 . . . . 0.0 110.787 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.54 130.31 35.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.194 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.2 p -75.94 79.06 2.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.421 0.629 . . . . 0.0 111.169 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -144.95 144.85 31.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.199 -176.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.74 119.58 69.46 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.77 -71.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.906 2.404 . . . . 0.0 112.822 -175.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.43 166.72 14.51 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.433 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.07 -41.2 97.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.957 0.408 . . . . 0.0 110.358 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.69 -37.1 81.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.509 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.62 -34.82 77.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.389 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -73.84 -12.07 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.48 177.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -93.15 -23.82 18.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.023 0.44 . . . . 0.0 110.221 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.9 mt -70.51 152.9 43.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.882 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -71.62 155.78 40.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.201 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HG3' HD23 ' A' ' 22' ' ' LEU . 1.8 mp0 -51.14 -49.68 60.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.363 0.414 . . . . 0.0 111.118 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.09 81.39 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.936 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.43 -38.94 74.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.021 0.439 . . . . 0.0 110.232 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.69 -38.33 80.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.175 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 82.8 mtp -63.41 -33.48 75.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.634 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -70.11 -38.31 75.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.812 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.82 -52.25 18.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.857 -177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -96.1 37.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.837 0.351 . . . . 0.0 110.579 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -43.44 -49.51 7.14 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -172.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -108.58 8.38 27.11 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.22 16.22 13.16 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.838 0.351 . . . . 0.0 110.227 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.446 ' O ' ' HD2' ' A' ' 90' ' ' PRO . 8.0 tt -126.42 146.54 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.322 -174.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.507 HG23 ' HB2' ' A' ' 90' ' ' PRO . 59.5 t -134.53 120.8 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.054 0.454 . . . . 0.0 110.446 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.1 mt -89.79 105.47 16.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.707 177.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.422 HG12 ' HB2' ' A' ' 92' ' ' ALA . 33.8 m -87.25 146.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.354 0.597 . . . . 0.0 111.271 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -91.4 117.69 5.25 Favored Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.816 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.521 ' HB3' HG23 ' A' ' 68' ' ' THR . 85.9 mt -95.1 7.26 46.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.764 0.426 . . . . 0.0 110.009 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 p -57.75 -30.61 65.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.712 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -73.45 -35.17 65.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.494 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.513 ' HB ' HG21 ' A' ' 68' ' ' THR . 36.1 mt -104.76 99.23 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.28 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.37 -21.01 63.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.538 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -97.57 37.43 1.37 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.514 0.674 . . . . 0.0 110.885 -176.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.521 HG23 ' HB3' ' A' ' 62' ' ' LEU . 1.0 OUTLIER -83.39 16.28 2.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.929 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -67.23 -20.48 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.201 0.524 . . . . 0.0 110.455 178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.96 -21.09 65.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.628 178.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 77' ' ' ILE . 13.3 tp -76.91 144.49 38.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.318 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -132.5 -172.47 2.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.402 -174.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 73' ' ' ARG . 19.0 mtp180 -100.86 129.57 46.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 173.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.41 33.82 6.99 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.053 -0.594 . . . . 0.0 111.879 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.56 163.45 12.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.014 0.435 . . . . 0.0 111.296 -175.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -120.7 112.62 19.09 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 170.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.41 HD12 HD12 ' A' ' 71' ' ' LEU . 42.0 pt -125.16 151.88 31.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.453 0.644 . . . . 0.0 111.899 -176.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.412 ' HE3' ' CH2' ' A' ' 80' ' ' TRP . 35.8 ttpt -107.99 107.42 18.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.881 175.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 34.3 m -100.25 157.98 3.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.016 0.436 . . . . 0.0 111.472 -174.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.497 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 11.0 m-90 -124.62 129.64 50.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.047 175.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.505 ' HB3' HG21 ' A' ' 94' ' ' ILE . 4.4 p90 -151.09 161.82 42.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.585 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -128.49 -35.67 1.93 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.1 m -93.88 106.24 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.649 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -103.87 133.31 49.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.396 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -112.69 93.87 4.64 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 43.2 tt0 -92.77 89.61 6.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.219 0.533 . . . . 0.0 110.218 -177.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -103.23 -3.65 25.41 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.267 -175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 63.43 97.3 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.435 0 O-C-N 123.755 0.66 . . . . 0.0 110.535 -175.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . 0.418 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 57.1 Cg_endo -70.28 150.18 91.03 Favored 'Cis proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.533 -1.445 . . . . 0.0 112.897 1.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.518 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.0 Cg_exo -61.13 146.3 97.76 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.024 2.483 . . . . 0.0 112.633 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.7 m -132.29 157.92 43.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.929 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.422 ' HB2' HG12 ' A' ' 60' ' ' VAL . . . -147.2 122.27 10.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.602 0.239 . . . . 0.0 111.224 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.4 m -84.23 110.56 18.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.505 HG21 ' HB3' ' A' ' 81' ' ' PHE . 41.5 pt -101.24 141.52 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.264 -174.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.494 ' HB2' ' SD ' ' A' ' 13' ' ' MET . 95.7 mt-30 -96.75 -21.29 17.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.627 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.494 ' HA ' HD12 ' A' ' 65' ' ' ILE . 57.8 tttm -158.31 146.02 18.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.539 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.8 p90 -128.0 174.71 8.96 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -143.59 118.71 10.1 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.4 tp -73.46 127.8 33.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.481 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.2 mt . . . . . 0 C--N 1.322 -0.616 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.71 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 71.2 mtp . . . . . 0 N--CA 1.453 -0.286 0 CA-C-O 120.517 0.198 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -100.63 125.49 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.599 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 60.0 p -92.52 149.56 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.283 0.564 . . . . 0.0 112.0 -174.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -146.74 131.47 17.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.181 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.4 t -98.18 126.32 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 158.79 27.8 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.416 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -84.8 124.2 31.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.401 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 15.0 t -81.68 107.95 14.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.466 HG12 ' HG2' ' A' ' 37' ' ' PRO . 27.1 m -114.99 -41.29 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.737 0.303 . . . . 0.0 111.665 -176.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.715 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 71.7 mt -120.94 144.72 48.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 68' ' ' THR . 48.4 tttm -148.36 132.04 16.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 0.0 111.65 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -111.82 -165.19 0.97 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 169.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -90.19 -25.92 20.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.426 0.631 . . . . 0.0 109.542 174.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -94.15 -32.48 13.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.645 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -143.9 161.48 38.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 0.0 111.048 -171.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.465 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -134.63 127.35 31.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.711 173.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.715 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 37.6 mt -93.83 111.21 24.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -177.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.401 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 23.8 mt -112.42 148.96 33.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.689 -174.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.2 mt -98.49 119.29 46.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 174.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 p -85.76 -14.37 45.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.141 0.495 . . . . 0.0 110.793 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -75.7 163.15 27.59 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.5 p -89.48 -11.85 41.76 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -76.69 105.58 7.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 0.0 110.695 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.98 137.58 61.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.209 176.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HG2' HG12 ' A' ' 21' ' ' VAL . 24.1 Cg_exo -63.61 151.5 84.77 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.087 2.524 . . . . 0.0 112.62 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.98 -175.62 39.49 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.932 177.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -51.75 -53.34 40.76 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.831 0.453 . . . . 0.0 111.621 -178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 4.2 mp0 -67.97 -26.82 66.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.342 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -69.89 -35.23 74.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.678 0.275 . . . . 0.0 110.775 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -72.37 -18.44 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.962 0.41 . . . . 0.0 110.526 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.05 -22.09 25.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 98.9 mt -63.9 151.53 42.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.4 p -75.23 163.13 27.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.976 0.417 . . . . 0.0 111.109 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -53.35 -45.64 69.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.319 -177.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.88 -47.0 93.41 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.577 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -61.57 -40.21 93.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.682 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.48 -43.27 97.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.389 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.4 ' HE1' HD11 ' A' ' 59' ' ' ILE . 66.0 mtt -66.64 -24.65 66.33 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.239 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -85.76 -35.91 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.274 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -73.04 -37.67 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.911 0.386 . . . . 0.0 110.652 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -107.68 39.2 1.97 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.229 0.538 . . . . 0.0 109.906 176.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -52.85 121.72 7.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.936 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.5 t30 73.84 -7.47 1.59 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.844 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.404 HD21 ' HA ' ' A' ' 56' ' ' ASN . 11.5 m120 -109.48 15.81 22.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.572 0.701 . . . . 0.0 110.106 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 21.0 tt -126.63 130.2 71.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.016 179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.487 HG21 ' HG2' ' A' ' 90' ' ' PRO . 95.2 t -115.44 128.83 72.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -172.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.4 HD11 ' HE1' ' A' ' 50' ' ' MET . 57.4 mt -94.34 101.94 13.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.631 176.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.6 m -80.99 145.94 8.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.102 0.477 . . . . 0.0 110.639 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 114.54 4.32 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.308 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.465 HD13 ' HB3' ' A' ' 28' ' ' ALA . 89.3 mt -98.76 13.74 31.22 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 177.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.0 t -61.48 -22.21 64.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.196 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -106.36 4.21 28.31 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.002 0.429 . . . . 0.0 110.709 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.8 mt -116.54 117.19 54.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.022 0.439 . . . . 0.0 110.608 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -92.14 -32.79 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 111.056 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -80.7 43.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.593 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . 0.507 ' O ' ' HE3' ' A' ' 23' ' ' LYS . 69.0 p -87.1 10.84 15.4 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 122.12 -0.363 . . . . 0.0 110.699 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.38 -36.09 60.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.849 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.37 -13.5 52.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.0 110.0 176.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.59 ' HB2' ' HH ' ' A' ' 97' ' ' TYR . 55.2 tp -79.28 100.74 7.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.654 175.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -106.22 148.12 28.29 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.598 -174.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' A' ' 21' ' ' VAL . 15.4 ptt180 -91.52 152.35 20.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.906 0.384 . . . . 0.0 110.238 177.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.87 25.67 8.37 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -169.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.01 -164.44 2.02 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.972 0.415 . . . . 0.0 111.132 -173.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB2' ' HZ3' ' A' ' 76' ' ' LYS . 5.6 mtmp? -131.47 141.55 49.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.243 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.8 pt -134.2 148.95 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.991 0.424 . . . . 0.0 110.945 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.453 ' HB2' HD13 ' A' ' 100' ' ' LEU . 50.0 tttp -103.31 106.83 17.44 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 175.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.1 m -97.17 147.09 6.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.498 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TRP . . . . . 0.452 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 16.0 m-90 -112.48 109.79 19.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.759 173.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.443 ' HB3' HG23 ' A' ' 94' ' ' ILE . 14.2 p90 -120.8 179.27 4.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -142.54 -38.72 0.36 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.36 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.5 m -110.41 121.72 45.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.68 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -108.87 132.97 53.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.24 0.543 . . . . 0.0 110.21 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -99.7 124.11 44.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.233 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -79.95 50.54 1.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.066 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -71.91 -29.29 64.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.585 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.4 t30 60.77 99.09 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 O-C-N 123.812 0.695 . . . . 0.0 111.268 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.83 153.31 79.86 Favored 'Cis proline' 0 C--N 1.344 0.341 0 C-N-CA 123.579 -1.425 . . . . 0.0 112.764 1.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.487 ' HG2' HG21 ' A' ' 58' ' ' VAL . 12.5 Cg_endo -56.16 138.81 84.3 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.918 2.412 . . . . 0.0 112.536 -177.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.8 t -118.35 137.88 52.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.435 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -128.38 102.83 6.83 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.867 0.365 . . . . 0.0 111.077 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.9 m -68.99 112.23 5.49 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.463 HG21 ' HB ' ' A' ' 79' ' ' VAL . 34.4 pt -106.19 147.88 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.018 0.437 . . . . 0.0 111.022 -175.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -111.1 -25.29 9.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.44 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -142.16 137.56 30.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.251 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TYR . . . . . 0.59 ' HH ' ' HB2' ' A' ' 71' ' ' LEU . 26.1 p90 -140.03 153.6 46.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.92 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.452 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 40.8 tt0 -114.9 128.76 56.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.815 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.89 105.85 10.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.384 -178.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.453 HD13 ' HB2' ' A' ' 78' ' ' LYS . 84.0 mt . . . . . 0 C--N 1.325 -0.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtm . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -92.17 -25.82 18.51 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.44 ' HE2' ' HB3' ' A' ' 3' ' ' LYS . 51.2 mtpt -84.94 88.93 7.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.417 172.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.42 135.41 57.42 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 176.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -45.97 125.59 6.48 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.677 0.611 . . . . 0.0 111.714 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.21 92.58 1.02 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -174.69 107.26 0.11 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.369 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 104.35 27.17 6.25 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.68 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -80.75 143.57 32.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.662 -0.269 . . . . 0.0 110.487 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.23 -52.16 17.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.062 0.458 . . . . 0.0 109.911 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.0 m -87.62 89.52 8.02 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.288 0.566 . . . . 0.0 110.056 176.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -75.5 104.64 6.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.175 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.6 mtp -87.62 147.66 25.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -83.73 115.16 22.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.029 0.442 . . . . 0.0 109.988 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.0 p -97.44 130.47 44.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.251 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.417 HD13 ' N ' ' A' ' 17' ' ' VAL . 0.6 OUTLIER -130.27 130.14 44.17 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.417 ' N ' HD13 ' A' ' 16' ' ' LEU . 50.8 t -95.54 123.51 47.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.22 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 176.61 27.29 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.706 -177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -101.24 134.84 43.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.66 0.267 . . . . 0.0 110.734 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 t -87.27 109.47 19.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.85 -36.76 4.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.103 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.716 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 89.6 mt -133.32 141.58 48.03 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -141.42 130.92 23.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.096 0.474 . . . . 0.0 111.624 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -115.83 -146.44 0.4 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 170.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -100.65 -55.73 2.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.029 0.377 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -90.46 -6.74 54.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.578 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -151.1 155.03 38.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.053 0.454 . . . . 0.0 111.437 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.463 ' HB3' HD11 ' A' ' 62' ' ' LEU . . . -141.72 149.5 40.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.085 176.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.716 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 70.4 mt -105.21 116.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.866 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 mt -118.78 151.91 37.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.282 0.563 . . . . 0.0 111.71 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -101.68 116.66 45.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.937 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.5 p -84.9 0.12 52.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.982 0.42 . . . . 0.0 111.301 -176.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 34' ' ' THR . 10.6 t70 -95.69 -172.22 2.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.496 178.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.418 ' H ' ' CG ' ' A' ' 33' ' ' ASP . 38.4 p -106.16 -2.29 22.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -174.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -86.27 124.19 32.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.841 0.353 . . . . 0.0 110.367 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 145.65 34.45 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.812 176.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -68.29 165.99 26.84 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.707 2.271 . . . . 0.0 112.44 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.4 176.61 37.09 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.19 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -51.62 -47.64 63.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 122.539 0.336 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.2 mt-10 -71.75 -26.24 62.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.532 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -67.1 -34.0 76.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.89 0.376 . . . . 0.0 110.201 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -74.27 -10.1 59.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.034 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -106.5 -5.11 19.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.877 0.37 . . . . 0.0 110.661 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 77.9 mt -74.54 163.78 27.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.491 ' HB2' ' HG3' ' A' ' 48' ' ' GLN . 16.3 m -76.18 149.25 37.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 50' ' ' MET . 1.6 mp0 -49.48 -51.17 37.78 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.533 0.521 . . . . 0.0 111.321 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.82 -39.08 94.93 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.623 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.491 ' HG3' ' HB2' ' A' ' 45' ' ' SER . 83.2 mt-30 -64.75 -41.89 95.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.996 0.427 . . . . 0.0 110.291 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.98 -38.88 86.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.602 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.425 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 80.7 mtp -62.32 -40.86 97.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.189 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -72.66 -25.37 61.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 110.875 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -81.57 -54.46 5.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -92.71 23.88 3.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 0.0 110.528 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -50.94 -28.8 10.53 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.518 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -66.27 -31.59 72.5 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -143.57 28.86 1.43 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -173.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.461 HD12 ' CG2' ' A' ' 29' ' ' ILE . 15.1 tt -96.56 134.93 32.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.525 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.498 HG23 ' HG2' ' A' ' 90' ' ' PRO . 79.4 t -132.83 127.26 55.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.868 0.366 . . . . 0.0 110.354 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 63.9 mt -95.05 116.95 37.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 176.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 22.6 m -95.6 142.43 13.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.167 0.508 . . . . 0.0 111.68 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.15 114.39 4.2 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.431 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.463 HD11 ' HB3' ' A' ' 28' ' ' ALA . 88.3 mt -96.59 9.87 40.22 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 122.61 0.364 . . . . 0.0 110.787 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.7 p -59.9 -31.15 69.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.074 0.464 . . . . 0.0 111.203 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.629 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 2.9 mm-40 -79.19 -19.46 50.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.293 -177.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.3 mt -103.55 113.37 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.584 -175.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -102.15 31.95 3.72 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.758 0.789 . . . . 0.0 110.618 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -145.3 37.72 1.13 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.3 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.453 HG23 ' HB3' ' A' ' 62' ' ' LEU . 40.7 p -69.86 5.01 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.04 -15.58 58.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.631 0.253 . . . . 0.0 111.287 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -89.3 -4.67 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.08 0.466 . . . . 0.0 109.944 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 tp -81.68 116.49 21.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.979 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -99.51 130.4 45.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.727 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.4 ptt85 -90.23 142.47 27.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.8 19.06 45.2 Favored Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 -171.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.416 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 6.1 mm-40 -134.67 -167.97 2.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.595 -171.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 88.3 tttt -127.76 138.77 52.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.924 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.493 HG23 HD12 ' A' ' 99' ' ' LEU . 38.3 pt -139.81 168.03 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 121.505 0.669 . . . . 0.0 112.233 -178.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -123.93 106.88 10.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.829 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.612 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.0 m -101.6 147.51 8.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -173.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.576 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 6.0 m-90 -110.22 115.4 29.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.815 173.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.471 ' HB3' HG22 ' A' ' 94' ' ' ILE . 44.2 p90 -127.94 172.34 10.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 0.0 111.008 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -155.95 -50.02 0.08 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.995 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 m -84.83 119.89 25.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.542 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 84' ' ' ARG . 13.9 ptt180 -139.13 153.03 47.92 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.938 0.399 . . . . 0.0 111.045 -176.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -120.64 106.43 11.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.71 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -86.96 97.94 10.98 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.14 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.8 m -112.27 -14.16 13.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.856 -175.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 60.73 93.59 0.06 OUTLIER Pre-proline 0 N--CA 1.467 0.411 0 O-C-N 123.479 0.487 . . . . 0.0 110.71 -172.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.415 ' HB3' HG23 ' A' ' 57' ' ' ILE . 14.7 Cg_exo -69.87 146.95 83.82 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.797 -1.335 . . . . 0.0 112.299 -1.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.498 ' HG2' HG23 ' A' ' 58' ' ' VAL . 62.0 Cg_endo -74.07 155.95 47.38 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.626 2.217 . . . . 0.0 112.783 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.6 p -128.02 145.05 51.11 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.712 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -129.95 128.54 42.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.681 0.277 . . . . 0.0 111.008 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.3 m -87.29 113.71 23.25 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.471 HG22 ' HB3' ' A' ' 81' ' ' PHE . 29.3 pt -108.29 129.44 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.059 0.457 . . . . 0.0 110.7 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.629 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 82.9 mt-30 -101.33 -9.43 21.18 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.664 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 51.6 tttm -158.72 140.98 14.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.3 165.76 26.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.872 0.367 . . . . 0.0 111.047 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -125.11 117.24 23.48 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.493 HD12 HG23 ' A' ' 77' ' ' ILE . 37.1 tp -70.64 137.99 50.37 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.375 -177.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 90.8 mt -112.45 -174.23 2.41 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.0 tp -153.18 148.0 26.4 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -176.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.67 -36.91 83.66 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.385 0.612 . . . . 0.0 110.183 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 51.4 t60 -72.8 -45.62 57.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.25 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -142.79 125.79 16.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.61 0.243 . . . . 0.0 110.509 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -80.84 -43.65 19.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.467 -175.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.4 87.42 0.63 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.904 0.383 . . . . 0.0 110.187 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -62.62 137.95 58.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.313 -173.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 40.9 m80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.465 -0.779 . . . . 0.0 109.464 178.458 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.729 0.299 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.2 t-20 -116.86 75.45 0.97 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -113.46 98.85 7.34 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.51 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -73.39 114.64 11.83 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.33 -45.98 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.555 -173.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 53.55 36.46 23.43 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.629 0.58 . . . . 0.0 110.562 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.33 129.3 46.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.67 -174.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.58 -142.03 7.34 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.995 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -70.68 -27.97 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.91 0.386 . . . . 0.0 110.946 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.11 -36.48 77.55 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.17 175.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.3 55.49 2.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.0 tttp -136.45 109.72 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 110.282 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 61.9 mtm -102.7 152.14 21.56 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -85.42 120.08 26.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.14 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.9 m -96.44 128.45 43.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.502 -174.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.424 HD11 ' CE1' ' A' ' 81' ' ' PHE . 11.6 mt -130.21 160.02 35.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.788 173.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -127.57 126.93 68.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.58 166.69 29.19 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.797 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -104.76 132.89 50.46 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.745 0.307 . . . . 0.0 110.285 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.47 HG23 HD12 ' A' ' 71' ' ' LEU . 12.0 t -89.15 100.65 11.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 m -92.12 -40.43 12.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.53 -177.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.786 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 99.0 mt -127.78 141.14 51.66 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.916 -178.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -126.39 136.25 52.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.759 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.679 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 7.7 t70 -135.92 -167.15 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.422 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 28.4 t-20 -79.49 106.96 11.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -176.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 71.41 7.99 6.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.324 0.65 . . . . 0.0 111.841 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.679 ' HG3' ' HB3' ' A' ' 24' ' ' ASP . 32.9 ptt180 -146.46 140.21 26.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.798 0.332 . . . . 0.0 110.398 -176.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.489 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -128.65 142.57 50.99 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.435 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.786 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 60.4 mt -97.68 107.07 19.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -102.15 147.28 26.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.959 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.428 ' HA ' ' O ' ' A' ' 56' ' ' ASN . 20.0 mt -106.31 123.71 61.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.076 173.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.5 p -81.71 -7.97 59.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.54 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.21 156.22 38.77 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 175.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.2 p -100.04 12.8 36.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -168.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -125.81 144.11 50.78 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 171.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.9 137.82 79.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 173.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.512 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 56.4 Cg_endo -69.99 177.38 5.79 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.474 2.116 . . . . 0.0 112.318 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.19 169.72 54.09 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.531 -0.843 . . . . 0.0 111.753 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -66.31 -27.01 67.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.573 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 37.4 mp0 -62.6 -42.49 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.376 176.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.512 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 14.2 m-20 -67.0 -35.27 79.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.433 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -69.6 -23.48 63.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.91 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.29 -15.37 38.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.423 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.7 mt -71.48 173.11 8.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.459 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.8 m -103.04 177.42 4.84 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.49 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.62 -47.54 81.91 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.073 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -33.15 72.39 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.635 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.477 ' HB3' HD12 ' A' ' 44' ' ' LEU . 78.8 mm-40 -65.07 -51.84 59.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.771 0.32 . . . . 0.0 110.63 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.3 mt -67.6 -31.38 71.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.491 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.625 ' HG3' ' HG3' ' A' ' 89' ' ' PRO . 47.9 ttm -63.01 -33.61 75.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.229 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -87.31 -44.62 11.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.224 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -69.82 -54.47 13.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.358 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.448 ' O ' HG21 ' A' ' 57' ' ' ILE . 99.4 m-85 -99.03 46.09 0.99 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tttp -52.15 -35.4 48.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.768 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -111.67 14.45 21.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.823 0.344 . . . . 0.0 111.425 -177.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.428 ' O ' ' HA ' ' A' ' 31' ' ' ILE . 18.6 m120 -122.88 -4.52 8.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.811 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.448 HG21 ' O ' ' A' ' 53' ' ' PHE . 13.2 tt -97.47 116.36 39.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.531 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.495 HG23 ' HB2' ' A' ' 90' ' ' PRO . 88.4 t -120.88 116.28 49.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.362 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.533 HG12 HG12 ' A' ' 29' ' ' ILE . 59.9 mt -85.32 104.72 13.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 34.9 m -93.92 141.29 15.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.167 0.508 . . . . 0.0 111.421 -175.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.37 130.62 9.82 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.589 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.516 ' HB3' HG22 ' A' ' 68' ' ' THR . 41.2 mt -105.61 7.74 32.89 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 124.177 0.575 . . . . 0.0 110.189 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.6 m -59.74 -28.56 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -172.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -95.07 -14.03 24.63 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.559 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 55.9 mt -107.34 104.28 16.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.73 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -77.53 -23.12 50.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.118 -177.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -85.55 41.04 0.87 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.222 0.534 . . . . 0.0 111.089 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.516 HG22 ' HB3' ' A' ' 62' ' ' LEU . 1.8 p -96.07 15.19 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.896 177.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -41.9 93.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.13 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.81 1.73 37.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.17 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.47 HD12 HG23 ' A' ' 20' ' ' VAL . 42.7 tp -77.11 121.18 23.23 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.299 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.4 mttp -120.69 -172.46 2.38 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.457 -175.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 -98.05 134.56 40.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 173.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 88.26 26.39 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -103.5 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.016 0.436 . . . . 0.0 110.51 -176.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -132.14 127.77 36.65 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 176.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.461 HG23 ' HA ' ' A' ' 99' ' ' LEU . 37.4 pt -137.25 155.01 31.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.426 0.631 . . . . 0.0 112.037 -176.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.411 ' HB2' HD13 ' A' ' 100' ' ' LEU . 86.0 tttt -106.95 114.8 29.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.574 173.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 22.6 m -104.56 139.5 25.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 0.0 111.944 -173.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 4.8 m-90 -109.4 122.82 48.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.118 170.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.424 ' CE1' HD11 ' A' ' 16' ' ' LEU . 2.0 p90 -149.06 177.13 9.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.073 0.463 . . . . 0.0 110.912 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -144.79 -42.01 0.24 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.3 m -82.5 104.76 13.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.163 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -98.76 117.35 33.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -99.2 115.39 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.543 . . . . 0.0 110.523 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.23 90.97 4.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.259 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -98.29 -31.11 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.873 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.83 90.46 0.08 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 124.015 0.822 . . . . 0.0 110.715 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.625 ' HG3' ' HG3' ' A' ' 50' ' ' MET . 36.7 Cg_endo -62.37 151.4 63.99 Favored 'Cis proline' 0 C--N 1.354 0.842 0 C-N-CA 124.762 -0.932 . . . . 0.0 114.16 7.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.495 ' HB2' HG23 ' A' ' 58' ' ' VAL . 51.6 Cg_exo -54.35 144.03 62.81 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.602 2.868 . . . . 0.0 113.911 -174.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.1 t -130.48 164.31 25.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.579 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.25 170.43 22.28 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.697 0.284 . . . . 0.0 110.484 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -126.66 117.32 22.51 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 27.0 pt -89.46 141.82 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.439 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -95.46 -35.07 11.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.908 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -158.75 149.19 19.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.398 175.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.476 ' OH ' ' HA ' ' A' ' 68' ' ' THR . 13.2 p90 -138.93 143.71 38.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.257 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -114.68 129.41 56.68 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.359 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.461 ' HA ' HG23 ' A' ' 77' ' ' ILE . 57.3 tp -76.17 122.47 24.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.621 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 78' ' ' LYS . 87.3 mt -112.11 84.09 1.91 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.3 tp -82.98 155.88 23.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.32 -177.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -59.22 -26.33 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.255 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 24.8 m80 -114.79 139.68 49.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.164 177.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -78.79 -31.43 46.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.915 -176.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -115.66 159.18 21.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.082 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -67.46 -42.53 82.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.523 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -135.11 -174.29 3.57 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 0.0 110.768 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.067 -177.179 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.524 0.202 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.4 t30 60.14 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -166.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.537 ' HE3' ' O ' ' A' ' 6' ' ' GLN . 57.3 tttp -92.92 105.57 17.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.985 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -67.49 117.43 9.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.567 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 64.29 -163.18 0.27 Allowed 'General case' 0 C--O 1.233 0.2 0 O-C-N 123.666 0.604 . . . . 0.0 109.805 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.537 ' O ' ' HE3' ' A' ' 3' ' ' LYS . 50.1 tt0 -103.47 -43.32 5.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.088 0.47 . . . . 0.0 109.968 177.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -123.75 111.69 16.45 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.202 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -78.91 178.28 53.59 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.335 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -90.36 143.68 26.53 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -78.53 -29.29 46.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.628 -178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.2 m -70.77 115.83 10.37 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.393 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -85.61 143.07 28.66 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.532 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.529 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 65.8 mtm -80.27 140.01 36.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.882 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -85.43 116.74 23.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 110.17 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.4 m -84.9 125.63 32.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.227 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.449 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 3.0 tm? -116.67 120.2 37.88 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.5 t -98.51 123.71 51.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.143 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.36 169.59 34.37 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.854 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -105.55 140.9 37.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.246 0.218 . . . . 0.0 110.52 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.478 HG22 HD11 ' A' ' 71' ' ' LEU . 22.6 t -87.76 113.92 25.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.64 -41.33 4.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.192 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.678 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 95.7 mt -134.02 160.17 38.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.814 0.34 . . . . 0.0 110.416 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -148.43 162.3 39.87 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.826 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -156.68 -164.68 1.7 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -75.81 -47.74 24.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 111.336 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -82.37 -45.89 14.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.861 -176.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.657 ' HG2' ' HA2' ' A' ' 61' ' ' GLY . 33.1 mtm180 -138.71 163.3 32.5 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.569 -169.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.404 ' HB2' HD13 ' A' ' 62' ' ' LEU . . . -116.12 152.49 33.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.314 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.678 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 58.6 mt -109.32 113.99 45.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.075 0.464 . . . . 0.0 110.787 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.451 HD11 HD12 ' A' ' 77' ' ' ILE . 66.9 mt -113.78 144.16 43.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.934 -176.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.3 mt -102.9 120.66 53.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -85.26 -7.58 58.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.095 0.474 . . . . 0.0 111.1 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.498 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 10.2 t70 -89.79 158.93 17.28 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.645 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.7 p -97.6 2.6 50.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -81.82 110.37 17.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 173.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.49 131.84 70.56 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.206 -175.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.35 160.39 47.94 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.845 2.363 . . . . 0.0 112.032 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.54 179.58 35.99 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.144 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.473 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 7.9 tmtm? -57.94 -41.42 82.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.851 0.358 . . . . 0.0 110.542 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.03 -27.51 64.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.235 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.08 -33.93 76.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.93 0.395 . . . . 0.0 109.967 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.45 -14.23 61.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -89.29 -22.18 22.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.009 0.433 . . . . 0.0 109.956 175.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -69.73 153.07 43.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.665 178.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.9 p -82.93 165.66 19.54 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.151 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.523 ' O ' ' HG3' ' A' ' 50' ' ' MET . 36.2 mp0 -48.72 -50.98 31.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.709 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.13 -48.99 83.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.748 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -64.02 -32.26 73.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.636 0.255 . . . . 0.0 111.142 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.8 tp -67.34 -41.85 84.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 65.0 mtt -65.7 -32.01 73.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -66.43 -36.03 81.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.867 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -82.81 -54.49 5.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.135 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.32 41.34 1.06 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.343 0.592 . . . . 0.0 110.238 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 77.9 tttt -60.79 124.99 22.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.607 -177.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 4.5 m-20 72.99 4.86 5.08 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.917 0.761 . . . . 0.0 111.256 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.498 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 13.6 m120 -118.63 11.91 12.96 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.491 HD13 ' HG2' ' A' ' 50' ' ' MET . 13.2 tt -129.06 134.2 64.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.196 -176.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 82.1 t -124.38 132.72 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.459 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' A' ' 91' ' ' SER . 29.8 mt -98.94 104.9 16.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.645 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.403 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 21.9 m -94.21 128.87 45.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.32 0.581 . . . . 0.0 111.297 -176.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.657 ' HA2' ' HG2' ' A' ' 27' ' ' ARG . . . -80.33 122.06 5.63 Favored Glycine 0 N--CA 1.443 -0.893 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.669 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.755 HD11 ' HG1' ' A' ' 68' ' ' THR . 80.7 mt -88.43 31.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.131 0.491 . . . . 0.0 110.061 -178.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.4 m -63.69 -26.17 68.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.632 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -105.26 -3.08 23.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.401 0.619 . . . . 0.0 110.081 177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.7 mm -122.62 91.05 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.997 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -98.21 18.09 17.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 122.08 0.943 . . . . 0.0 109.913 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -121.15 14.39 11.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.493 -173.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.755 ' HG1' HD11 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -79.8 32.52 0.26 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -171.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -89.49 -14.66 34.8 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.363 0.601 . . . . 0.0 109.717 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -81.8 -28.52 33.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.451 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.478 HD11 HG22 ' A' ' 20' ' ' VAL . 12.6 tp -57.36 123.29 14.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.806 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -104.73 170.74 7.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 111.165 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.8 mtt85 -87.22 143.3 27.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.24 -0.437 . . . . 0.0 109.979 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.58 42.0 18.74 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -124.28 -174.88 3.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.221 0.534 . . . . 0.0 112.017 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.455 ' H ' ' HE1' ' A' ' 105' ' ' HIS . 56.7 tttm -135.2 125.2 25.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.712 -175.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.541 HG23 ' HA ' ' A' ' 99' ' ' LEU . 2.6 pp -135.6 171.47 17.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.488 0.661 . . . . 0.0 112.708 -174.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -135.15 111.73 9.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.697 174.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.521 HG13 HD13 ' A' ' 77' ' ' ILE . 27.8 m -107.29 156.02 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.816 0.341 . . . . 0.0 111.208 -176.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.529 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 9.8 m-90 -122.69 130.59 53.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.838 175.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.534 ' HB3' ' HA ' ' A' ' 94' ' ' ILE . 44.5 p90 -148.33 -178.34 6.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.034 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -140.99 -45.06 0.39 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.02 175.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.3 m -82.94 117.76 23.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 49.9 ptt85 -139.61 155.04 47.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.758 0.313 . . . . 0.0 110.58 176.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -122.34 128.98 51.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.372 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.52 59.49 4.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.42 0.628 . . . . 0.0 110.139 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -79.12 -22.27 45.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.697 177.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.456 HD21 ' N ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER 68.69 102.06 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.811 179.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.441 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 16.3 Cg_exo -69.0 146.8 81.63 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.829 -1.321 . . . . 0.0 112.194 -0.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 29.9 Cg_exo -61.26 137.56 71.5 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.837 2.358 . . . . 0.0 112.624 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.404 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 14.6 m -115.93 145.97 42.47 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.146 176.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -147.41 128.95 15.02 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.588 -176.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 46.7 m -83.41 112.77 20.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.534 ' HA ' ' HB3' ' A' ' 81' ' ' PHE . 40.9 pt -87.04 149.85 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.105 0.479 . . . . 0.0 111.287 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -103.65 -48.09 4.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.32 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -138.48 163.97 30.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.05 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.418 ' CB ' HG11 ' A' ' 79' ' ' VAL . 6.2 p90 -164.23 159.06 19.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.665 0.269 . . . . 0.0 110.725 177.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -121.01 132.75 55.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.711 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.541 ' HA ' HG23 ' A' ' 77' ' ' ILE . 38.4 tp -82.1 108.98 16.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.963 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.96 94.38 9.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.406 0.622 . . . . 0.0 109.858 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 23.2 tp -81.92 89.16 6.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.639 -175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.566 ' HB2' ' CD2' ' A' ' 105' ' ' HIS . 37.1 mt-10 -63.61 163.76 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.37 177.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -64.96 -28.42 69.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 169.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -54.91 -32.51 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.79 172.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . 0.632 ' HA ' ' CE1' ' A' ' 108' ' ' HIS . 14.0 m170 -81.88 -8.21 59.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.707 -172.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -76.87 -25.15 52.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.17 -177.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -146.06 99.32 3.23 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.632 ' CE1' ' HA ' ' A' ' 105' ' ' HIS . 28.2 p-80 . . . . . 0 C--O 1.249 1.027 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.474 ' HB3' ' H ' ' A' ' 2' ' ' ASN . 80.8 mmm . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 120.527 0.203 . . . . 0.0 110.865 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.474 ' H ' ' HB3' ' A' ' 1' ' ' MET . 21.1 p-10 -74.81 14.35 0.52 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -170.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.758 ' HB2' ' HG3' ' A' ' 5' ' ' GLU . 93.4 mttt -98.7 4.03 47.79 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 173.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 62.31 36.51 14.54 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.417 0.627 . . . . 0.0 109.918 -175.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.758 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 12.9 mt-10 -70.93 147.68 48.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.892 -1.049 . . . . 0.0 112.199 -173.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.25 -43.22 21.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.209 172.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -110.03 138.83 45.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.373 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 153.16 -57.48 0.42 Allowed Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.595 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -99.28 -87.35 0.36 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.498 0.189 . . . . 0.0 111.499 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 61.89 11.09 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.123 0.569 . . . . 0.0 111.621 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.5 p -88.36 131.34 34.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.328 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.9 126.5 30.59 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 110.295 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.432 ' SD ' ' HD2' ' A' ' 96' ' ' LYS . 83.2 mtp -119.89 156.25 31.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.813 -179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -83.26 121.81 27.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.762 0.315 . . . . 0.0 110.4 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 m -82.74 125.36 31.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.074 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.488 ' O ' HG21 ' A' ' 79' ' ' VAL . 2.7 tm? -138.72 120.59 15.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -89.97 139.16 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -149.61 145.5 13.75 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.18 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.868 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 87.5 m-85 -91.61 121.14 33.01 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.418 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 40.0 t -75.82 93.57 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.48 -38.13 7.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.094 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.772 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 93.2 mt -121.91 124.75 44.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.155 0.503 . . . . 0.0 110.19 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -124.61 119.05 27.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.936 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -118.47 13.61 13.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.121 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 75.08 -55.08 0.65 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.922 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -85.24 -36.77 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 27' ' ' ARG . 43.1 mtp180 -113.39 148.36 35.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.759 176.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.481 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -138.69 130.81 28.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.02 0.438 . . . . 0.0 110.62 175.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.772 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 66.8 mt -104.34 115.78 46.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.4 mt -114.47 147.18 39.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.125 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.89 129.12 53.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 168.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.5 p -53.93 -58.61 6.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.77 0.319 . . . . 0.0 111.005 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.868 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 35.4 t70 -164.71 140.4 5.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.52 0.676 . . . . 0.0 111.952 174.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.3 m -146.97 17.11 1.23 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm 48.25 64.02 1.83 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.975 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 61.58 96.43 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.994 -179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -62.73 167.73 11.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.774 2.316 . . . . 0.0 111.998 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -92.18 167.0 30.01 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.978 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -62.97 -28.97 70.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.224 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 39.4 tt0 -66.06 -33.58 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.547 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.86 -34.03 73.05 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -73.87 -19.24 60.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.868 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -78.69 -30.92 46.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.357 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.8 mt -63.3 142.91 58.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.351 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.2 m -76.0 168.91 19.17 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.404 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.53 -49.55 45.62 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.495 0.497 . . . . 0.0 111.537 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.6 -45.62 95.99 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.22 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.73 -41.49 92.18 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.969 0.414 . . . . 0.0 110.675 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.13 -43.52 98.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.165 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 45.9 ttm -67.21 -34.35 77.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.342 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -71.7 -24.65 61.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.709 0.29 . . . . 0.0 111.245 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.88 -54.84 3.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.951 0.405 . . . . 0.0 110.777 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -97.4 40.17 1.17 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.639 -177.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -54.84 -34.99 63.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.417 -173.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -92.37 -5.34 52.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.678 0.275 . . . . 0.0 111.422 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -121.48 3.17 10.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.6 tt -96.28 121.91 47.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.327 0.584 . . . . 0.0 110.834 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.8 t -124.48 121.98 62.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.075 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 60.3 mt -91.76 105.85 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 34.1 m -98.75 150.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.264 0.554 . . . . 0.0 111.296 -175.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.53 126.58 8.68 Favored Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.841 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' HG23 ' A' ' 68' ' ' THR . 85.4 mt -100.72 19.0 17.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.182 0.515 . . . . 0.0 109.853 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.1 m -61.27 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.583 -176.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.65 -51.47 11.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.281 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 49.1 mt -89.28 108.68 19.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.469 -176.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.22 12.13 19.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.824 0.345 . . . . 0.0 111.227 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -112.89 34.52 4.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.304 0.573 . . . . 0.0 109.572 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.537 HG23 ' HB3' ' A' ' 62' ' ' LEU . 5.8 p -89.3 2.53 54.21 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -80.22 -11.32 59.75 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.944 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.37 -25.03 63.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.295 172.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.26 158.61 28.51 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.536 174.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -142.86 154.45 44.15 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.722 178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.51 118.07 14.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.155 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 106.2 22.69 7.73 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.136 -0.785 . . . . 0.0 111.136 -175.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -113.48 165.08 12.82 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -127.42 124.39 38.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.922 0.392 . . . . 0.0 110.554 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.536 HG22 ' HA ' ' A' ' 99' ' ' LEU . 39.5 pt -130.24 153.14 38.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.782 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.427 ' HE3' ' CZ2' ' A' ' 80' ' ' TRP . 35.9 ttpt -111.8 110.66 21.14 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.488 HG21 ' O ' ' A' ' 16' ' ' LEU . 8.6 m -99.6 159.23 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 111.869 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.427 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 20.9 m-90 -127.77 128.41 45.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.467 173.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -134.83 175.17 9.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.155 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -95.81 -37.75 10.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.161 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.1 t -154.71 157.19 37.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.501 ' HG3' ' HB1' ' A' ' 92' ' ' ALA . 50.7 ttp180 -121.39 134.92 55.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -88.11 125.26 34.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.951 0.405 . . . . 0.0 110.376 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -80.83 74.52 7.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.209 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -86.68 -24.3 25.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.899 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 33.4 t30 61.09 92.17 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.685 -174.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.44 156.75 96.76 Favored 'Cis proline' 0 C--N 1.345 0.355 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.392 -0.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.11 139.88 92.56 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.863 2.375 . . . . 0.0 112.662 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 18.1 p -135.31 142.75 45.89 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.501 ' HB1' ' HG3' ' A' ' 84' ' ' ARG . . . -158.28 139.06 12.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.706 0.289 . . . . 0.0 111.19 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -81.17 115.77 20.75 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.4 pt -86.31 135.83 24.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.123 0.487 . . . . 0.0 110.488 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -106.05 -22.89 12.77 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.979 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.432 ' HD2' ' SD ' ' A' ' 13' ' ' MET . 65.2 mttp -142.88 147.34 35.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.915 177.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.467 ' HB3' HG13 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -152.81 156.77 39.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.987 0.423 . . . . 0.0 110.677 171.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -114.84 112.0 22.09 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.536 ' HA ' HG22 ' A' ' 77' ' ' ILE . 6.1 tt -72.31 113.31 9.21 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.9 mt -69.31 118.18 11.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.201 -172.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.92 96.59 0.06 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.23 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -59.08 125.7 24.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.512 176.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -57.32 -47.92 80.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.126 -176.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 11.8 m170 57.68 81.13 0.15 Allowed 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -87.15 -16.25 35.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -93.82 100.96 13.05 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 160.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -95.62 114.63 26.4 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 . . . . . 0 C--O 1.241 0.647 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.327 168.079 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttp . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 111.293 0.109 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.7 t30 -134.01 -14.72 2.35 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.417 ' HB2' ' OE2' ' A' ' 5' ' ' GLU . 99.4 mttt -92.44 8.63 37.81 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.967 -0.458 . . . . 0.0 111.178 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.79 75.83 0.36 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.201 0.524 . . . . 0.0 109.72 -174.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.417 ' OE2' ' HB2' ' A' ' 3' ' ' LYS . 60.1 mp0 -87.46 -46.83 9.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.447 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -87.21 111.04 20.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.074 0.464 . . . . 0.0 110.624 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -137.54 173.13 12.0 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.785 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.1 2.64 51.59 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.545 -178.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -130.1 110.22 11.44 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -126.62 -41.44 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.65 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 15.9 m -65.03 96.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.529 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -115.53 107.2 14.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.339 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.608 ' HE2' ' HB2' ' A' ' 95' ' ' GLN . 75.4 mtp -86.21 172.0 10.85 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 85.1 mm-40 -83.76 115.19 22.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.089 0.471 . . . . 0.0 109.865 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.6 t -96.93 129.9 44.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.222 -172.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.9 137.37 29.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.7 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 62.1 t -97.68 137.76 24.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 154.5 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.432 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.7 127.14 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.409 ' HA ' HD21 ' A' ' 30' ' ' LEU . 10.9 t -83.02 102.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 p -120.51 -49.41 3.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.591 ' HB3' ' HB ' ' A' ' 29' ' ' ILE . 25.8 tp -122.7 138.76 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.773 0.32 . . . . 0.0 110.855 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.4 ' HZ1' ' C ' ' A' ' 72' ' ' LYS . 37.9 mttp -131.06 162.87 28.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.869 0.366 . . . . 0.0 110.781 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -123.05 -69.87 0.8 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.351 171.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -166.09 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.936 176.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -93.8 -15.43 25.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.243 0.544 . . . . 0.0 110.268 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -116.49 141.37 48.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.811 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -121.41 145.94 47.4 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.425 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.591 ' HB ' ' HB3' ' A' ' 22' ' ' LEU . 66.6 mt -107.33 108.17 24.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.963 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.409 HD21 ' HA ' ' A' ' 20' ' ' VAL . 58.8 mt -116.06 149.8 38.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.981 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.432 HD13 ' HG3' ' A' ' 37' ' ' PRO . 54.6 mt -109.26 122.05 63.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.9 p -94.3 7.56 44.96 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.588 ' CG ' ' H ' ' A' ' 34' ' ' THR . 31.9 t70 -163.58 -162.73 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.588 ' H ' ' CG ' ' A' ' 33' ' ' ASP . 6.5 m 82.15 23.07 0.23 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.686 0.795 . . . . 0.0 111.854 175.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.0 tttm 56.8 42.52 26.5 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.414 169.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.63 134.36 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.543 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.432 ' HG3' HD13 ' A' ' 31' ' ' ILE . 45.1 Cg_exo -56.25 136.58 76.07 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.826 2.351 . . . . 0.0 112.107 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.63 -163.34 30.3 Favored Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.713 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -52.64 -58.29 7.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.859 0.464 . . . . 0.0 111.89 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.604 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -68.34 -27.29 66.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -67.76 -30.55 70.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.83 0.348 . . . . 0.0 110.648 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -83.49 -1.77 54.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.845 0.355 . . . . 0.0 111.06 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -110.6 -10.97 14.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 93.1 mt -79.6 149.15 31.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.031 0.443 . . . . 0.0 111.248 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.7 m -88.77 -178.93 5.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.242 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -55.2 -60.84 2.83 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.03 -33.97 86.1 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.569 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -71.49 -37.26 71.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.362 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.97 -42.77 94.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.566 176.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.411 ' HE1' ' HG3' ' A' ' 89' ' ' PRO . 80.4 mtp -66.77 -23.64 66.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.922 177.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -74.95 -42.24 58.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.856 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -77.17 -45.71 25.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 110.668 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.532 ' O ' HG22 ' A' ' 57' ' ' ILE . 89.2 m-85 -98.81 44.65 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -175.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -44.09 -39.2 4.07 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -121.29 9.81 10.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -176.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -120.22 -5.45 9.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.532 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.8 tt -99.37 132.06 45.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.928 0.394 . . . . 0.0 109.955 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 63.5 t -122.97 126.97 74.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.945 0.403 . . . . 0.0 110.617 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.6 mt -96.72 100.91 11.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.6 m -89.1 141.99 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.124 0.488 . . . . 0.0 111.374 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.77 115.33 4.63 Favored Glycine 0 N--CA 1.441 -0.996 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.18 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.45 HD12 ' HB3' ' A' ' 28' ' ' ALA . 80.4 mt -94.47 27.09 3.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 0.0 110.123 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.5 m -55.57 -35.84 66.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.89 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.429 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 14.8 mm-40 -81.87 -6.91 59.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 111.092 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -114.32 99.91 9.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -68.45 -41.06 80.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.414 -174.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -107.01 106.75 17.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.929 0.395 . . . . 0.0 110.737 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -98.3 18.58 16.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.425 0.631 . . . . 0.0 109.517 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.39 -29.83 70.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.304 -171.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -81.28 -17.81 48.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt -71.5 125.06 26.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.908 0.385 . . . . 0.0 110.568 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.4 ' C ' ' HZ1' ' A' ' 23' ' ' LYS . 22.4 mttp -106.68 -172.59 2.11 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.878 -176.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 ttt180 -111.36 126.01 54.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 177.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 33.65 5.36 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.781 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.09 179.58 3.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 111.103 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.483 ' HD2' ' HG2' ' A' ' 102' ' ' GLU . 48.9 mttp -129.44 129.6 44.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.397 176.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.531 HG21 ' HA ' ' A' ' 99' ' ' LEU . 30.1 pt -130.84 145.13 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.019 0.438 . . . . 0.0 111.275 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.66 ' HZ2' ' HB3' ' A' ' 78' ' ' LYS . 8.1 ttpm? -106.34 107.27 18.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.2 m -98.24 154.25 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.019 0.438 . . . . 0.0 111.711 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.551 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 23.2 m-90 -121.34 115.45 22.97 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.132 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.497 ' HB3' HG21 ' A' ' 94' ' ' ILE . 5.5 p90 -118.01 166.83 12.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.556 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -126.97 -25.61 3.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.357 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.8 m -117.86 111.61 19.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.937 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.7 mtm180 -108.45 140.1 42.25 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.035 172.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -121.59 110.23 15.74 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -79.25 87.6 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.985 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.4 p -102.15 -26.78 13.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.207 177.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.5 m120 57.98 90.96 0.08 OUTLIER Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.348 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.411 ' HG3' ' HE1' ' A' ' 50' ' ' MET . 46.3 Cg_endo -67.82 136.04 32.19 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.81 1.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.75 153.31 29.69 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.61 2.207 . . . . 0.0 113.039 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -116.01 153.64 31.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.336 176.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -148.08 132.82 17.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.743 0.306 . . . . 0.0 110.758 -179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.9 m -90.71 116.22 28.41 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.936 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.497 HG21 ' HB3' ' A' ' 81' ' ' PHE . 46.8 pt -101.66 148.59 7.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.946 0.403 . . . . 0.0 110.725 -178.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.608 ' HB2' ' HE2' ' A' ' 13' ' ' MET . 97.0 mt-30 -111.44 -28.2 8.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.36 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -136.94 152.83 50.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.725 -179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -154.56 144.95 22.1 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -114.55 118.26 33.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.047 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.531 ' HA ' HG21 ' A' ' 77' ' ' ILE . 3.0 tt -77.62 111.11 13.04 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.78 111.76 13.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.426 -175.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.499 HD23 ' HB2' ' A' ' 106' ' ' HIS . 41.1 tp -82.58 83.29 7.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.253 0.549 . . . . 0.0 110.141 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.483 ' HG2' ' HD2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -87.55 -19.87 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.163 178.341 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -74.44 88.48 2.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -55.79 -44.42 77.74 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -163.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -80.18 60.74 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.034 -0.666 . . . . 0.0 111.548 -171.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . 0.499 ' HB2' HD23 ' A' ' 101' ' ' LEU . 63.8 m80 -137.27 9.27 2.95 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.205 172.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -118.36 -76.65 0.57 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.378 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 68.8 t60 . . . . . 0 C--O 1.245 0.824 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.492 176.654 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.7 mtt . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -136.29 20.04 3.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -75.43 -29.32 59.69 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.335 176.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 65.5 t30 64.35 33.86 11.03 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.605 0.717 . . . . 0.0 110.378 176.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -24.35 66.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.853 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.07 14.81 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.441 -176.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -78.34 -14.87 59.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.232 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -62.37 -23.61 64.72 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.971 -0.558 . . . . 0.0 113.231 -177.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.25 -47.99 74.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 110.886 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -82.7 -45.81 13.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.256 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.2 m -90.98 95.52 10.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.688 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.56 106.66 4.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.44 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.0 mtm -86.23 158.87 19.62 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.109 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -83.78 125.45 31.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.981 0.42 . . . . 0.0 110.474 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.0 m -85.24 124.72 32.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.539 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.477 HD13 ' HA ' ' A' ' 32' ' ' THR . 2.9 tm? -121.98 112.85 18.79 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.1 t -93.36 115.23 31.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 -172.07 18.12 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.752 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.35 136.06 54.82 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.923 0.392 . . . . 0.0 110.918 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.427 HG23 ' CD2' ' A' ' 30' ' ' LEU . 13.0 t -85.59 93.82 3.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.497 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 m -82.64 -34.98 12.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.842 -178.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.669 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.7 mt -133.52 127.58 33.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.107 0.479 . . . . 0.0 110.613 178.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -111.92 126.27 54.93 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.271 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.778 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 37.0 t70 -128.21 166.4 18.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 81.1 m-20 -67.77 106.56 2.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.835 0.35 . . . . 0.0 110.141 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 47.7 mt-10 78.82 5.81 2.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.645 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.778 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 9.3 mpt_? -127.83 119.61 26.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.914 0.388 . . . . 0.0 110.955 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -110.27 107.98 17.93 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 62.8 mt -85.73 104.35 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.49 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.427 ' CD2' HG23 ' A' ' 20' ' ' VAL . 36.5 mt -111.54 151.74 28.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.529 -171.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 58.6 mt -97.45 123.71 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 168.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.477 ' HA ' HD13 ' A' ' 16' ' ' LEU . 12.2 p -78.6 -10.59 59.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.018 0.437 . . . . 0.0 111.396 -177.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.491 ' OD1' ' HG3' ' A' ' 35' ' ' LYS . 6.1 t70 -89.64 162.05 15.81 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.9 p -100.96 9.59 42.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.491 ' HG3' ' OD1' ' A' ' 33' ' ' ASP . 68.0 mttm -77.25 131.7 38.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.238 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.5 122.79 73.39 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.504 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 165.89 30.94 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.797 2.332 . . . . 0.0 112.168 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.72 -172.59 27.96 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.776 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.77 -41.27 99.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.027 0.441 . . . . 0.0 110.488 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 34.4 tt0 -64.71 -37.12 86.52 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.39 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.448 ' O ' HD23 ' A' ' 49' ' ' LEU . 15.0 m-20 -60.53 -45.03 95.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -70.88 -14.35 62.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.527 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -93.91 -15.44 24.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.752 0.31 . . . . 0.0 110.749 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.3 mt -72.53 154.19 40.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.2 176.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.1 p -84.98 170.14 13.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -176.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -50.24 -48.75 54.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.236 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.3 -43.18 99.45 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.616 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -70.92 -35.96 72.46 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.77 -0.253 . . . . 0.0 111.348 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 41' ' ' ASP . 67.3 mt -68.91 -36.92 78.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.89 0.376 . . . . 0.0 110.471 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.471 ' HA ' HG21 ' A' ' 57' ' ' ILE . 42.6 ttm -61.78 -34.58 76.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.504 176.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -82.71 -44.35 15.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.319 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.09 -34.32 74.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -114.41 43.1 1.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.121 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -50.63 119.53 3.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.107 -176.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 69.15 0.19 2.73 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.75 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -96.15 -20.42 18.62 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 170.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.471 HG21 ' HA ' ' A' ' 50' ' ' MET . 8.4 tt -90.24 123.32 42.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.358 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -125.51 125.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.251 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.65 HG12 HG12 ' A' ' 29' ' ' ILE . 58.0 mt -94.57 108.86 21.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.53 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 24.8 m -98.25 143.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.471 . . . . 0.0 110.88 -179.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.44 134.0 12.7 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.102 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 26' ' ' GLU . 69.4 mt -105.42 16.33 25.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.827 0.346 . . . . 0.0 110.245 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.2 m -60.54 -33.07 72.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.303 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.41 -33.87 61.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.684 0.278 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.7 mt -108.33 97.73 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.304 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.51 6.78 22.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.28 0.562 . . . . 0.0 110.88 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -99.12 14.51 29.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.21 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.512 HG22 HD23 ' A' ' 62' ' ' LEU . 6.9 p -86.4 7.64 24.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.62 -12.46 59.5 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.281 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.77 -19.99 61.93 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.981 174.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.426 HD23 HG21 ' A' ' 20' ' ' VAL . 25.3 tp -67.54 147.35 52.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.61 178.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -119.47 172.4 7.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.185 0.516 . . . . 0.0 111.73 -178.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -84.9 126.25 33.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.489 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.11 26.31 19.3 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -175.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -95.64 160.04 14.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 111.142 -173.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.514 ' HG2' HD12 ' A' ' 100' ' ' LEU . 46.4 tttp -117.92 111.31 18.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -177.475 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.451 HG23 HD11 ' A' ' 99' ' ' LEU . 44.5 pt -132.4 171.84 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.745 0.783 . . . . 0.0 112.943 -173.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -133.45 111.65 10.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.882 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.482 ' HB ' HG22 ' A' ' 94' ' ' ILE . 34.9 m -106.62 157.43 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -117.39 123.06 45.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.098 172.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -126.22 157.71 37.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.813 0.34 . . . . 0.0 110.554 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -87.4 -36.88 17.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.093 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.8 t -150.11 168.61 23.42 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.238 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -123.77 132.0 53.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -110.21 95.24 5.46 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -82.81 84.6 7.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.198 0.523 . . . . 0.0 110.996 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 m -84.78 -12.47 53.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.115 175.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.7 m120 60.31 89.99 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.546 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.462 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 58.3 Cg_endo -70.13 151.24 92.23 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.877 -1.301 . . . . 0.0 113.132 2.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 11.0 Cg_exo -71.14 153.11 62.58 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.096 2.53 . . . . 0.0 113.107 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 t -135.4 160.91 36.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.654 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.53 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -158.14 170.66 21.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 23.9 m -131.74 130.9 42.51 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.482 HG22 ' HB ' ' A' ' 79' ' ' VAL . 44.5 pt -109.09 145.05 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.966 0.412 . . . . 0.0 111.158 -176.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -109.13 -16.24 14.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -161.71 147.72 13.78 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -152.19 164.9 36.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -114.8 136.45 53.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.867 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.451 HD11 HG23 ' A' ' 77' ' ' ILE . 29.8 tp -92.26 118.88 31.32 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.514 HD12 ' HG2' ' A' ' 76' ' ' LYS . 93.7 mt -83.43 119.03 24.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.196 0.522 . . . . 0.0 110.582 -176.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.4 mt -75.52 -1.6 25.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.529 -176.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.2 -14.15 62.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.198 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 t60 -56.04 -51.95 65.99 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.441 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -119.19 81.63 1.74 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.167 0.508 . . . . 0.0 109.642 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.85 121.53 17.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.974 -177.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -85.4 120.33 26.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -113.56 135.37 53.98 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.737 -0.649 . . . . 0.0 109.891 -178.073 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.9 mtp . . . . . 0 N--CA 1.482 1.158 0 CA-C-O 120.533 0.206 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -99.04 129.14 45.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 0.0 111.525 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -79.39 -33.01 43.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 169.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -110.52 105.99 15.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.751 173.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.22 -57.06 11.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.454 -174.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.51 89.38 6.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.1 0.476 . . . . 0.0 110.305 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -85.05 98.42 10.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.545 0.688 . . . . 0.0 110.332 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -141.19 135.33 6.82 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.113 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -69.25 95.39 0.77 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.453 0.645 . . . . 0.0 110.146 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -163.01 -50.61 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.208 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 p -93.96 90.0 6.29 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.029 169.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -76.61 143.55 40.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.344 0.593 . . . . 0.0 111.446 -173.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.406 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 67.4 mtm -90.94 123.77 34.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.749 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.39 116.55 22.54 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.497 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 12.3 t -103.9 144.57 31.33 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.199 0.523 . . . . 0.0 111.694 -171.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.517 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.0 OUTLIER -135.52 136.99 41.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.49 ' N ' HD11 ' A' ' 16' ' ' LEU . 58.7 t -106.19 124.11 61.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.7 0.286 . . . . 0.0 110.393 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.25 167.72 29.0 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.11 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -104.94 128.01 53.02 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.477 HG23 HD11 ' A' ' 71' ' ' LEU . 21.9 t -75.69 99.2 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.444 HG12 ' CE2' ' A' ' 42' ' ' TYR . 34.6 m -98.27 -38.73 7.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.671 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.708 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 94.4 mt -131.46 131.5 43.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.667 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -116.07 119.77 36.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.548 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -88.42 -73.69 0.49 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.396 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 171.73 -64.13 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.66 -25.72 21.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.141 175.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.9 OUTLIER -116.55 151.89 35.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.694 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' A' ' 62' ' ' LEU . . . -129.35 127.84 41.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.65 173.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.708 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 68.0 mt -89.68 107.93 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.2 mt -111.24 137.72 48.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.486 -177.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.431 HD13 HD11 ' A' ' 49' ' ' LEU . 9.7 mt -105.27 148.76 9.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.461 HG22 HD13 ' A' ' 16' ' ' LEU . 19.1 p -128.76 155.18 45.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.268 -176.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 54.28 41.26 32.08 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.631 0.582 . . . . 0.0 111.122 176.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -108.77 -4.59 16.81 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.011 -175.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.37 36.06 23.26 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.956 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 64.34 107.45 0.03 OUTLIER Pre-proline 0 N--CA 1.464 0.253 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.87 -173.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.404 ' HG2' ' CE1' ' A' ' 42' ' ' TYR . 26.4 Cg_endo -63.14 163.67 22.14 Favored 'Trans proline' 0 C--O 1.237 0.443 0 C-N-CA 122.802 2.334 . . . . 0.0 112.293 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.458 ' O ' ' HD1' ' A' ' 42' ' ' TYR . . . -89.82 172.22 38.54 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.887 -178.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.18 -25.54 68.12 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.659 0.266 . . . . 0.0 111.128 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.88 -29.96 56.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.071 0.462 . . . . 0.0 110.175 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -69.95 -35.7 74.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.458 ' HD1' ' O ' ' A' ' 38' ' ' GLY . 69.3 m-85 -71.12 -16.21 62.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.458 174.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -83.41 -28.94 28.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.045 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -67.9 142.55 56.03 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.306 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 m -91.32 -174.14 3.84 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.474 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -52.55 -56.22 16.75 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.026 -173.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.91 92.74 Favored Glycine 0 N--CA 1.454 -0.144 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.388 -177.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.63 -39.33 80.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.578 0.228 . . . . 0.0 111.148 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.431 HD11 HD13 ' A' ' 31' ' ' ILE . 90.7 mt -78.26 -35.67 47.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.964 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 42.9 ttm -58.83 -42.73 89.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -93.24 2.76 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.463 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -100.56 -40.48 7.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.196 0.522 . . . . 0.0 109.76 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . 0.528 ' HB3' ' HB2' ' A' ' 56' ' ' ASN . 81.0 m-85 -118.58 55.58 0.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.59 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -51.5 -35.95 42.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.5 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -100.42 -8.77 22.88 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.593 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.528 ' HB2' ' HB3' ' A' ' 53' ' ' PHE . 2.9 m-20 -114.02 2.03 14.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -171.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 12.6 tt -98.48 123.74 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.113 0.482 . . . . 0.0 110.861 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -125.02 126.02 70.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.967 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 91' ' ' SER . 61.6 mt -97.84 105.18 16.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.9 m -90.68 150.44 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.277 -176.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.66 119.59 6.53 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.883 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' A' ' 28' ' ' ALA . 35.4 mt -92.33 7.99 40.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.09 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.0 t -65.46 -23.69 66.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.296 -170.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -97.72 5.52 49.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.088 0.47 . . . . 0.0 111.214 -175.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 52.3 mt -95.75 154.96 3.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.253 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -68.93 0.13 Allowed 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.363 0.414 . . . . 0.0 110.928 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -163.41 131.04 3.55 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.494 HG21 HD13 ' A' ' 62' ' ' LEU . 37.0 p -97.29 35.3 1.63 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.039 -174.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -68.28 -22.56 64.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.091 -177.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -92.95 5.93 49.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.112 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.477 HD11 HG23 ' A' ' 20' ' ' VAL . 24.1 tp -99.02 121.19 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.365 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -114.1 -172.57 2.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.954 0.407 . . . . 0.0 110.544 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -85.47 146.1 27.11 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.479 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.417 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 76.46 39.93 29.19 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.636 174.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -127.02 158.62 36.45 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.619 -177.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.5 mttp -102.62 136.45 42.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.4 pt -133.1 140.44 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.336 0.589 . . . . 0.0 111.25 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -100.29 106.82 18.5 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 173.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 15' ' ' SER . 29.2 m -100.16 154.11 4.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.582 -172.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.494 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 18.6 m-90 -120.61 117.65 28.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.414 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.531 ' HB3' HG23 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -133.88 167.15 21.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.825 -175.354 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -152.37 -37.7 0.11 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.739 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.433 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 7.1 m -80.23 108.02 13.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.451 176.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -102.52 153.51 20.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.148 0.499 . . . . 0.0 111.532 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.622 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 98.0 mttt -133.6 114.01 13.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.747 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.9 58.31 3.35 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.852 0.834 . . . . 0.0 109.697 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.6 t -76.37 -16.4 59.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.171 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 p30 42.92 100.08 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 112.382 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.15 150.07 75.3 Favored 'Cis proline' 0 C--N 1.345 0.381 0 C-N-CA 123.804 -1.332 . . . . 0.0 113.053 3.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.47 136.54 74.96 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.014 2.476 . . . . 0.0 112.524 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.622 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 19.7 m -115.72 149.03 39.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.567 177.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.418 ' HB2' ' CD2' ' A' ' 81' ' ' PHE . . . -143.53 121.63 12.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.794 0.33 . . . . 0.0 111.258 -177.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.433 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 29.3 m -82.07 113.67 20.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.531 HG23 ' HB3' ' A' ' 81' ' ' PHE . 35.2 pt -96.18 142.58 13.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.033 0.444 . . . . 0.0 110.697 -177.358 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -90.59 -19.28 23.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.092 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -171.01 150.26 3.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.655 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.77 157.94 31.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 23.2 tt0 -115.54 112.34 22.06 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.5 tp -71.58 107.18 4.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.739 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.5 mt -81.83 90.8 6.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.477 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.05 140.89 57.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.484 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.485 ' HB3' ' O ' ' A' ' 108' ' ' HIS . 21.4 mm-40 -67.35 -175.8 0.52 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.614 0.721 . . . . 0.0 112.431 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -99.71 -0.93 39.08 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.802 -167.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 72.6 m80 -137.69 152.22 49.05 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.749 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -84.11 -34.92 24.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.27 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -130.24 42.12 3.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.861 0.363 . . . . 0.0 111.731 -176.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -160.71 -87.36 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.054 176.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . 0.485 ' O ' ' HB3' ' A' ' 102' ' ' GLU . 54.0 t60 . . . . . 0 C--O 1.238 0.45 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.417 ' HB3' ' H ' ' A' ' 2' ' ' ASN . 56.7 mtt . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.814 0.34 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.417 ' H ' ' HB3' ' A' ' 1' ' ' MET . 1.7 m-20 -54.48 -47.59 72.81 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -169.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 tttt -74.12 -9.49 58.68 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.773 -173.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -67.96 -10.98 57.77 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.061 0.458 . . . . 0.0 111.099 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -80.66 -30.02 36.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.161 176.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -129.71 103.47 6.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.595 -175.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.97 -39.65 86.4 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.85 -110.34 3.12 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.2 -0.909 . . . . 0.0 113.919 170.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -64.88 -19.39 65.88 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -171.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -90.03 -0.85 57.81 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.303 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.1 p -132.29 122.15 24.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.888 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -87.35 119.3 27.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.537 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 95.8 mmm -98.24 130.68 44.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.267 175.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.512 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 83.9 mm-40 -83.38 118.62 23.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 111.195 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 m -81.15 111.9 18.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.457 HD13 HG23 ' A' ' 32' ' ' THR . 2.0 tm? -130.92 124.89 32.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.75 132.3 37.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.786 0.327 . . . . 0.0 110.327 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.59 162.78 28.93 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.755 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -105.84 126.03 51.7 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.576 0.227 . . . . 0.0 110.648 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.44 107.62 4.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.448 HG12 ' HG ' ' A' ' 22' ' ' LEU . 12.2 p -120.23 -32.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 123.271 0.357 . . . . 0.0 111.062 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.965 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.9 mt -127.73 145.07 51.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.818 0.342 . . . . 0.0 110.999 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -119.1 135.8 54.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.35 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.544 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 0.9 OUTLIER -92.77 -66.77 0.9 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.141 171.128 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.544 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 6.1 t30 160.9 -51.45 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.18 -24.76 14.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.406 -1.27 . . . . 0.0 108.69 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 24.3 mtm180 -117.92 158.95 23.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.607 -1.178 . . . . 0.0 110.464 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.502 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -124.61 139.87 53.47 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 175.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.965 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 32.5 mt -102.41 109.29 26.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 mt -113.16 144.39 42.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.047 -172.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.76 119.74 35.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.883 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.457 HG23 HD13 ' A' ' 16' ' ' LEU . 75.9 p -81.78 -23.66 36.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.959 0.409 . . . . 0.0 110.665 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -78.48 95.08 5.05 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 t -63.88 90.69 0.06 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.155 0.978 . . . . 0.0 112.127 -173.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -138.35 135.56 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.656 -1.157 . . . . 0.0 108.356 172.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.35 113.24 15.41 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.498 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.0 158.02 50.27 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.62 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.37 168.99 48.92 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.938 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -64.1 -28.12 69.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.948 0.404 . . . . 0.0 110.593 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -81.38 -26.56 35.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.911 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.67 -34.73 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -69.33 -16.19 63.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.665 175.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -94.53 -18.06 21.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.772 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.92 152.87 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.117 0.484 . . . . 0.0 110.953 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.3 p -77.51 166.62 22.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.322 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.406 ' HA ' ' CD1' ' A' ' 22' ' ' LEU . 37.2 tt0 -52.77 -52.69 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.936 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.68 -42.13 99.71 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.686 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -68.04 -37.38 81.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.754 0.277 . . . . 0.0 111.654 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.506 HD12 HD23 ' A' ' 22' ' ' LEU . 72.8 mt -70.42 -34.17 72.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.796 0.331 . . . . 0.0 110.501 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.422 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 62.7 mtt -73.22 -15.7 61.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.094 176.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -91.04 -40.16 11.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.861 0.363 . . . . 0.0 110.35 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.31 -47.71 69.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.449 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.65 46.86 0.94 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.81 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 50' ' ' MET . 57.0 tttp -56.27 131.14 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -176.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 69.19 -5.52 1.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.276 -0.874 . . . . 0.0 112.206 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -106.14 9.75 32.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.579 0.704 . . . . 0.0 109.495 176.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 20.2 tt -120.48 128.62 76.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.603 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.509 HG23 ' HG2' ' A' ' 90' ' ' PRO . 53.7 t -121.98 137.84 54.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.893 0.378 . . . . 0.0 110.969 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 91' ' ' SER . 56.5 mt -95.93 111.13 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.97 139.03 18.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.155 0.502 . . . . 0.0 111.231 -177.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -87.57 113.09 3.93 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.502 HD12 ' HB3' ' A' ' 28' ' ' ALA . 59.5 mt -87.55 43.13 1.09 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.026 0.441 . . . . 0.0 110.39 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.4 t -59.52 -45.51 91.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.654 -176.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.661 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 1.1 mp0 -87.86 11.09 16.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.05 0.453 . . . . 0.0 111.27 -176.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 51.4 mm -106.45 134.38 48.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.44 -64.27 1.21 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.163 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -123.69 140.64 52.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.7 p -111.45 27.58 9.54 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.163 0.506 . . . . 0.0 111.551 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -73.01 -25.13 60.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.189 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -74.59 -27.22 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.692 0.282 . . . . 0.0 111.118 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.06 125.13 25.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -114.74 150.98 34.49 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 48.2 mtm105 -68.83 112.46 5.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 171.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.0 33.38 4.67 Favored Glycine 0 N--CA 1.443 -0.897 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 -174.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -118.53 151.38 37.96 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.474 ' HG2' HD12 ' A' ' 100' ' ' LEU . 81.1 tttt -111.8 122.99 49.3 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.827 0.346 . . . . 0.0 110.755 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.431 HG21 HD13 ' A' ' 99' ' ' LEU . 38.2 pt -132.14 149.6 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.296 0.57 . . . . 0.0 111.347 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -105.96 108.13 19.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.487 HG13 ' HB3' ' A' ' 97' ' ' TYR . 28.2 m -98.66 153.02 4.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.255 0.55 . . . . 0.0 111.632 -173.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.537 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 8.5 m-90 -121.2 113.46 20.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.802 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.61 ' HA ' ' HA ' ' A' ' 94' ' ' ILE . 30.4 p90 -107.24 146.93 30.84 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.619 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -99.22 -25.17 14.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.326 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -160.29 152.59 20.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.454 ' HA ' ' HA ' ' A' ' 92' ' ' ALA . 32.9 mtm180 -110.25 169.75 8.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.344 0.592 . . . . 0.0 111.064 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 91' ' ' SER . 57.5 tttp -140.74 91.39 2.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.015 -0.993 . . . . 0.0 108.47 173.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.534 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 35.2 tt0 -83.96 109.81 17.92 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.363 -173.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -121.08 -0.27 10.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.417 174.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 59.37 102.08 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.47 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.212 -175.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.42 146.07 72.14 Favored 'Cis proline' 0 C--N 1.344 0.301 0 C-N-CA 123.563 -1.432 . . . . 0.0 112.24 0.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.534 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 20.6 Cg_endo -62.82 138.78 70.82 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.489 2.126 . . . . 0.0 112.202 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 28.2 t -104.0 156.09 18.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 84' ' ' ARG . . . -147.56 108.58 4.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.685 0.278 . . . . 0.0 110.911 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.4 m -73.02 110.08 7.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.859 0.361 . . . . 0.0 110.601 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.61 ' HA ' ' HA ' ' A' ' 81' ' ' PHE . 45.4 pt -98.95 147.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.356 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.661 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 96.7 mt-30 -109.61 -8.98 14.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.581 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -165.98 148.74 7.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.172 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' HB3' HG13 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -137.35 167.37 21.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 172.475 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -129.32 131.06 46.84 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.431 HD13 HG21 ' A' ' 77' ' ' ILE . 17.4 tp -79.17 111.87 15.83 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -178.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.474 HD12 ' HG2' ' A' ' 76' ' ' LYS . 86.0 mt -82.5 130.4 35.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.983 -178.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.4 mt -95.26 130.84 41.86 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.6 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -67.52 107.9 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -83.43 69.43 10.03 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.337 0.589 . . . . 0.0 109.792 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -72.17 151.93 42.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -72.96 -24.98 60.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.257 -175.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 82.6 t60 69.46 16.33 8.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.808 0.814 . . . . 0.0 109.504 -173.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -86.28 -17.68 33.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 43.1 m80 . . . . . 0 C--O 1.247 0.968 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.155 174.801 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -74.42 -29.67 61.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 171.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -105.73 99.21 8.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.633 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -105.76 172.94 6.53 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.196 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -79.86 68.79 6.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.436 0.636 . . . . 0.0 111.547 -172.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -171.34 -66.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.581 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -91.38 41.89 1.08 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 0.0 110.737 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -169.02 31.51 0.17 Allowed Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.494 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.508 ' CG ' ' H ' ' A' ' 10' ' ' GLU . 11.2 t70 -112.89 -164.03 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.508 ' H ' ' CG ' ' A' ' 9' ' ' ASP . 35.2 mt-10 -124.85 -20.41 5.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.744 0.307 . . . . 0.0 111.113 -175.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.1 t -83.69 148.62 26.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.161 0.505 . . . . 0.0 110.763 -177.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.38 90.89 3.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.687 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.408 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 72.8 mtp -119.99 140.61 50.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.333 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.46 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.4 mt-30 -88.67 135.3 33.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.848 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.578 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 35.8 p -101.67 139.43 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.634 -174.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.3 tp -140.34 120.82 14.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.542 177.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.429 HG22 ' HB2' ' A' ' 78' ' ' LYS . 55.9 t -90.23 127.01 43.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.293 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.64 158.6 27.73 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.148 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.78 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 80.0 m-85 -99.37 129.77 45.6 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.494 HG22 HD12 ' A' ' 71' ' ' LEU . 13.8 t -83.07 108.4 15.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.227 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.2 m -103.34 -28.48 3.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 123.318 0.386 . . . . 0.0 111.033 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.89 HD23 HD13 ' A' ' 29' ' ' ILE . 39.2 tp -136.21 122.82 20.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.869 0.366 . . . . 0.0 110.55 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -105.96 123.57 48.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.659 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -113.04 167.57 10.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.84 -31.96 68.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.63 0.252 . . . . 0.0 111.517 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -122.76 1.86 9.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.593 0.235 . . . . 0.0 111.324 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -142.83 167.78 21.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.82 0.343 . . . . 0.0 110.665 -174.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.473 ' HB1' HD13 ' A' ' 62' ' ' LEU . . . -145.72 119.66 9.35 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.8 173.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.89 HD13 HD23 ' A' ' 22' ' ' LEU . 33.3 mt -85.73 107.86 16.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-O 121.217 0.532 . . . . 0.0 110.014 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.431 ' CD2' HG21 ' A' ' 20' ' ' VAL . 20.2 mt -110.44 141.94 42.85 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.163 -176.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.407 ' CG2' ' HG1' ' A' ' 34' ' ' THR . 60.4 mt -101.92 122.13 53.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 172.145 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -71.47 91.77 1.06 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.083 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.78 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 45.9 t0 65.22 93.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.848 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.407 ' HG1' ' CG2' ' A' ' 31' ' ' ILE . 0.2 OUTLIER -101.44 10.66 40.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.233 177.683 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 56.13 35.66 26.06 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -172.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.43 102.98 0.03 OUTLIER Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.61 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.4 157.21 32.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.869 2.38 . . . . 0.0 112.391 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.11 166.85 39.11 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.641 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -57.67 -37.38 73.29 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.744 0.307 . . . . 0.0 111.06 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.434 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 19.2 mm-40 -73.84 -24.01 59.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.64 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.6 -33.87 71.53 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.507 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 80.5 m-85 -74.82 -17.92 60.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.363 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -90.12 -12.62 37.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.062 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 85.5 mt -67.42 166.14 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.129 0.49 . . . . 0.0 111.079 176.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.1 p -97.65 171.78 8.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.4 ' O ' ' HG3' ' A' ' 50' ' ' MET . 34.1 tt0 -53.82 -55.8 23.35 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.303 -177.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -57.9 -41.19 94.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.264 -0.493 . . . . 0.0 112.842 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -63.42 -44.38 94.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.738 0.304 . . . . 0.0 110.692 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.68 -42.74 98.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.4 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 88.9 mtp -60.22 -33.88 72.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.652 -179.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -92.22 -34.89 14.1 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -71.33 -47.78 54.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.9 0.381 . . . . 0.0 110.425 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -106.04 44.08 1.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.633 0.73 . . . . 0.0 109.86 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 81.3 tttt -54.62 140.6 34.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.246 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.434 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 92.7 m-20 76.37 -40.96 0.4 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.62 0.768 . . . . 0.0 112.329 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -80.83 -1.04 41.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 0.0 110.806 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.479 HG22 ' HB3' ' A' ' 89' ' ' PRO . 7.4 tt -90.8 118.77 36.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.308 0.575 . . . . 0.0 110.43 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -117.92 125.19 74.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.108 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.671 HG12 HG12 ' A' ' 29' ' ' ILE . 55.1 mt -99.49 100.35 10.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.43 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 35.5 m -83.66 154.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.403 ' CA ' ' HA ' ' A' ' 93' ' ' THR . . . -96.41 125.95 8.63 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.934 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.534 ' HB3' HG23 ' A' ' 68' ' ' THR . 86.6 mt -109.31 9.74 25.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 -178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -64.78 -21.99 66.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.451 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -91.88 0.66 57.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.709 0.29 . . . . 0.0 111.156 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.34 117.8 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.868 0.365 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.76 -55.88 6.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.047 0.451 . . . . 0.0 111.658 -176.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -85.35 66.85 9.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.208 0.528 . . . . 0.0 111.736 -173.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.534 HG23 ' HB3' ' A' ' 62' ' ' LEU . 69.1 p -99.54 8.9 44.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.229 172.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.79 -18.92 65.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.731 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -77.51 -12.43 59.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.302 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.54 HD11 ' HG3' ' A' ' 75' ' ' GLU . 15.5 tp -87.92 126.25 34.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.792 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.413 ' HD2' ' OE2' ' A' ' 75' ' ' GLU . 35.8 mttt -112.76 -179.82 3.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.133 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -88.57 59.56 5.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.85 0.357 . . . . 0.0 110.417 174.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.507 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 176.54 42.61 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.54 ' HG3' HD11 ' A' ' 71' ' ' LEU . 40.5 mm-40 -111.87 173.18 6.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.288 0.566 . . . . 0.0 111.441 -173.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -137.48 102.23 4.72 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.641 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.1 pt -125.44 154.9 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.764 0.793 . . . . 0.0 113.093 -170.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.49 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 43.3 tttt -115.77 106.44 13.86 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.301 -1.318 . . . . 0.0 108.551 175.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.578 ' O ' ' HA ' ' A' ' 15' ' ' SER . 22.1 m -96.14 156.86 3.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -169.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.49 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 5.4 m-90 -122.99 126.44 47.16 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.338 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -136.86 160.16 39.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.584 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -96.45 -23.08 16.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -157.57 158.51 35.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.124 -174.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -122.98 154.16 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.18 0.514 . . . . 0.0 110.805 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -103.68 102.51 12.37 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -77.85 62.24 2.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.911 -175.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.7 p -81.66 -30.15 32.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.031 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 66.3 101.72 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.42 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.669 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.479 ' HB3' HG22 ' A' ' 57' ' ' ILE . 31.3 Cg_endo -63.11 142.13 42.3 Favored 'Cis proline' 0 C--N 1.347 0.484 0 C-N-CA 123.779 -1.342 . . . . 0.0 112.657 2.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -58.91 134.91 63.26 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.79 2.327 . . . . 0.0 112.159 -178.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.3 p -123.45 144.59 49.41 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.85 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -151.26 110.3 3.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.285 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.403 ' HA ' ' CA ' ' A' ' 61' ' ' GLY . 12.8 m -68.29 117.25 9.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.216 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.505 HG23 ' HB ' ' A' ' 79' ' ' VAL . 42.5 pt -100.6 151.77 5.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.154 0.502 . . . . 0.0 110.938 -176.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -112.78 -18.65 12.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.338 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -143.1 151.13 40.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.777 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.446 ' HB3' HD13 ' A' ' 94' ' ' ILE . 1.2 p90 -155.93 150.01 25.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.965 0.412 . . . . 0.0 110.02 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.44 124.47 52.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.413 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.63 117.67 23.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.952 0.406 . . . . 0.0 110.393 -177.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt -111.94 -179.85 3.81 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.084 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.641 ' HG ' ' H ' ' A' ' 102' ' ' GLU . 26.8 tp -157.92 -176.74 6.1 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.408 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.641 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 7.2 mm-40 -78.68 175.92 9.97 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -86.33 20.86 2.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.64 0.733 . . . . 0.0 109.708 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -140.74 169.73 17.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.149 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -68.06 -32.78 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.067 -0.253 . . . . 0.0 111.324 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -121.36 -90.71 0.57 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.053 0.454 . . . . 0.0 109.885 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -147.99 -51.85 0.18 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 68.9 t60 . . . . . 0 C--O 1.246 0.89 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.35 171.911 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.5 mtt . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -144.99 99.02 3.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -77.57 158.34 29.89 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.579 0.704 . . . . 0.0 112.181 -174.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.733 HD22 ' HB3' ' A' ' 6' ' ' GLN . 16.3 t30 -109.48 125.77 52.81 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.872 174.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.49 -28.85 66.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.979 0.419 . . . . 0.0 110.423 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.733 ' HB3' HD22 ' A' ' 4' ' ' ASN . 42.0 tt0 -59.3 -33.23 70.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 173.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 57.8 t30 60.25 92.58 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.578 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -148.25 -160.24 8.9 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.354 -0.699 . . . . 0.0 111.354 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -89.38 -14.63 35.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.063 0.458 . . . . 0.0 109.856 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 67.93 31.45 5.64 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.703 176.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -90.14 10.88 22.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.752 0.787 . . . . 0.0 109.29 171.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 14.6 pttm -75.67 117.6 17.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.438 0.637 . . . . 0.0 109.986 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 70.3 mtm -107.89 125.78 51.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.264 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -83.66 121.11 26.82 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.263 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.519 ' HB3' ' HE2' ' A' ' 78' ' ' LYS . 48.8 m -85.42 129.24 34.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.123 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -137.5 124.56 21.54 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.8 t -90.31 126.67 43.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.99 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.44 169.31 29.05 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.359 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.402 ' CD2' ' HG2' ' A' ' 76' ' ' LYS . 94.2 m-85 -107.14 133.96 50.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.657 0.265 . . . . 0.0 110.353 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.0 t -85.39 110.27 19.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.34 -177.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.8 t -107.23 -63.19 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 123.497 0.498 . . . . 0.0 110.704 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 1.018 HD22 HD12 ' A' ' 29' ' ' ILE . 41.6 tp -111.51 110.47 20.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.948 0.404 . . . . 0.0 110.702 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.514 ' HE3' ' HA ' ' A' ' 69' ' ' ASP . 42.6 tttm -100.01 126.58 46.22 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.498 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 15.7 t70 -106.27 -158.08 0.64 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 174.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.498 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 72.9 m-20 -89.1 -54.72 3.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.172 0.511 . . . . 0.0 109.747 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -98.26 -10.72 23.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.027 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.2 mtt180 -131.87 149.7 52.37 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.733 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -127.13 115.36 19.0 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 172.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 1.018 HD12 HD22 ' A' ' 22' ' ' LEU . 34.7 mt -87.94 107.55 17.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.394 0.616 . . . . 0.0 110.396 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 29.3 mt -114.32 158.13 21.86 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.416 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . 0.546 ' CG2' ' HB ' ' A' ' 34' ' ' THR . 36.9 mt -110.37 123.8 66.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.3 p -78.14 107.85 11.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.375 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 54.05 75.49 0.27 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.634 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.546 ' HB ' ' CG2' ' A' ' 31' ' ' ILE . 10.0 t -108.56 -0.01 20.56 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.637 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.8 mttp 57.11 41.18 27.67 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.837 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.98 112.57 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.8 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.507 ' HG3' HG22 ' A' ' 34' ' ' THR . 6.5 Cg_exo -73.03 178.88 5.95 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.833 2.356 . . . . 0.0 111.469 176.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.5 166.23 25.27 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.31 -178.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -62.79 -27.21 69.15 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.6 mt-10 -59.71 -47.6 85.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.363 174.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -67.04 -32.87 74.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.833 -175.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.492 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 53.6 m-85 -73.45 -16.44 61.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 111.058 177.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -93.44 -22.14 19.08 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.07 0.462 . . . . 0.0 110.143 178.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 89.7 mt -69.52 157.1 37.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.056 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -88.1 179.07 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.363 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.422 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -58.9 -43.58 91.06 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.346 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.8 -42.27 93.13 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.478 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -64.16 -39.53 94.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.065 0.46 . . . . 0.0 110.429 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.2 tp -68.96 -48.38 63.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.34 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 41.3 ttm -55.88 -49.02 74.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.918 -174.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -81.98 -8.43 59.67 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -90.11 -51.5 5.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.003 0.43 . . . . 0.0 110.408 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -101.75 33.24 3.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -56.89 -29.52 63.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -170.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -101.44 3.43 40.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.452 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -132.84 18.16 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.124 0.487 . . . . 0.0 110.063 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.439 HD13 ' CG2' ' A' ' 29' ' ' ILE . 17.5 tt -109.75 134.08 52.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.744 -174.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.4 t -132.64 122.59 47.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.042 0.448 . . . . 0.0 110.448 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.709 HG12 HG12 ' A' ' 29' ' ' ILE . 48.4 mt -92.99 103.62 14.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.46 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.469 ' CG2' ' HB2' ' A' ' 28' ' ' ALA . 34.0 m -83.1 145.64 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.136 0.493 . . . . 0.0 110.714 -178.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.75 122.41 6.65 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.103 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD13 ' HB3' ' A' ' 28' ' ' ALA . 68.5 mt -98.98 11.62 38.41 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.925 0.426 . . . . 0.0 110.188 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 m -57.42 -25.16 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.675 -174.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -98.37 6.47 47.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.158 0.504 . . . . 0.0 111.015 -176.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.0 mt -125.25 107.02 17.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -84.63 21.19 1.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.817 0.341 . . . . 0.0 111.792 -174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -157.77 81.58 0.87 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.16 0.505 . . . . 0.0 109.769 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.495 HG21 ' HB3' ' A' ' 62' ' ' LEU . 10.2 p -114.21 9.08 17.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.908 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.514 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 41.7 m-20 -79.49 2.67 21.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.115 0.483 . . . . 0.0 111.292 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -82.29 -13.7 56.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.576 170.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.8 tp -76.2 130.63 38.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.468 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.558 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 4.2 mtpm? -106.02 165.12 11.44 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.393 -177.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -89.96 123.8 34.19 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 175.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.492 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 98.01 37.5 4.38 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.754 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.558 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 67.4 mm-40 -116.61 175.75 5.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 111.74 -174.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.402 ' HG2' ' CD2' ' A' ' 19' ' ' TYR . 52.9 mtpt -124.44 123.57 40.44 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.182 177.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.5 pt -135.41 153.76 34.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.622 0.725 . . . . 0.0 112.294 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.519 ' HE2' ' HB3' ' A' ' 15' ' ' SER . 56.0 tttm -110.39 106.52 15.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.588 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 26.7 m -94.56 154.29 3.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.148 0.499 . . . . 0.0 112.179 -172.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.7 m0 -118.47 104.13 10.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.455 175.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.491 ' HB3' HG22 ' A' ' 94' ' ' ILE . 53.1 p90 -117.67 145.48 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.08 0.467 . . . . 0.0 110.637 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -99.29 -39.19 8.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.4 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 38.4 m -120.34 124.32 45.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.274 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -117.85 118.69 32.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.822 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -117.84 115.86 25.82 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.084 0.468 . . . . 0.0 109.76 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.538 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 36.2 mt-10 -87.95 85.61 7.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.286 0.565 . . . . 0.0 110.544 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 m -91.23 -6.62 53.08 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.633 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.1 t30 66.68 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.538 -176.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -75.01 156.35 99.91 Favored 'Cis proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.375 -1.51 . . . . 0.0 112.641 -0.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.538 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.3 Cg_exo -61.28 141.2 92.2 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.914 2.409 . . . . 0.0 112.686 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.9 t -132.29 141.51 49.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.863 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -138.32 130.78 29.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.668 0.27 . . . . 0.0 110.775 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.6 m -83.68 119.76 25.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.491 HG22 ' HB3' ' A' ' 81' ' ' PHE . 44.9 pt -102.66 150.4 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.85 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.66 -48.96 4.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.101 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -140.67 169.7 17.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.457 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -155.72 158.11 37.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 0.0 110.895 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.511 ' HB2' ' HB3' ' A' ' 78' ' ' LYS . 43.1 mt-10 -114.57 121.76 44.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.269 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 tp -72.9 121.48 20.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.2 mt -94.48 110.68 22.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.049 0.452 . . . . 0.0 110.49 -177.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.85 160.4 31.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.494 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HG2' ' H ' ' A' ' 103' ' ' HIS . 0.5 OUTLIER -97.55 -175.81 3.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.727 0.299 . . . . 0.0 110.227 -177.227 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.528 ' H ' ' HG2' ' A' ' 102' ' ' GLU . 77.2 t60 -83.44 -38.73 21.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 -178.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -102.95 172.4 6.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -89.73 -13.43 36.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.373 0.606 . . . . 0.0 109.502 173.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -116.5 157.12 25.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.301 177.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -107.11 -34.66 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.132 0.492 . . . . 0.0 109.774 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 9.8 m170 . . . . . 0 C--O 1.245 0.821 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.219 175.576 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.593 0.235 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -109.49 -16.66 13.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.762 0.315 . . . . 0.0 111.242 -176.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -111.62 -164.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.106 178.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -75.29 -21.2 58.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.091 0.472 . . . . 0.0 110.382 177.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.53 172.56 13.34 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.466 173.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -105.25 -72.06 0.72 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.689 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.0 t30 174.64 -48.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 O-C-N 123.813 0.695 . . . . 0.0 109.535 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -76.77 9.31 24.19 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.827 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.81 -34.71 78.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.354 0.597 . . . . 0.0 109.845 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -77.75 -36.67 50.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.726 -177.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -75.4 149.52 38.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.088 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -86.25 105.2 16.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.346 0.594 . . . . 0.0 110.925 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.473 ' HE3' ' HB3' ' A' ' 80' ' ' TRP . 75.2 mtp -90.86 128.61 36.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.232 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -90.74 130.24 36.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.791 0.329 . . . . 0.0 111.177 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -79.34 129.12 34.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.905 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.431 HD23 HG22 ' A' ' 32' ' ' THR . 1.5 tt -128.46 116.88 20.39 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.2 t -98.79 122.59 50.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 155.97 26.65 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.38 -178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.438 ' O ' ' HA ' ' A' ' 30' ' ' LEU . 83.7 m-85 -83.99 127.87 34.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.675 0.274 . . . . 0.0 111.012 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.1 t -81.25 96.49 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.0 m -97.02 -36.92 6.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.858 0.361 . . . . 0.0 111.257 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.652 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 81.1 mt -140.25 147.15 39.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -135.94 140.9 44.36 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.4 -177.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 34.8 t70 -121.0 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.451 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 46.9 t30 -82.32 -33.88 28.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.461 . . . . 0.0 110.169 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -95.3 -33.16 12.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.848 -177.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -139.31 164.92 28.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.918 0.39 . . . . 0.0 111.35 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.519 ' HB1' HD11 ' A' ' 62' ' ' LEU . . . -129.72 133.79 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.978 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.758 HG22 HD12 ' A' ' 57' ' ' ILE . 71.0 mt -90.65 107.04 18.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.026 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.438 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 40.6 mt -112.83 136.81 52.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.619 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.4 mt -95.33 120.04 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 174.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.431 HG22 HD23 ' A' ' 16' ' ' LEU . 20.6 p -90.25 22.89 3.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.969 -175.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -97.31 -167.07 1.48 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.266 -179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -99.26 -23.44 15.19 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.222 0.534 . . . . 0.0 110.707 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -87.1 140.02 29.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.923 -177.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -98.84 130.98 26.46 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 168.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.465 ' HB3' ' CB ' ' A' ' 41' ' ' ASP . 57.3 Cg_exo -53.76 150.11 30.47 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.959 2.439 . . . . 0.0 112.876 -177.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.72 -171.54 35.94 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.635 -0.793 . . . . 0.0 111.996 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.06 -42.88 77.3 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 122.614 0.366 . . . . 0.0 110.843 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.625 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.8 mt-10 -65.4 -41.22 93.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.944 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.465 ' CB ' ' HB3' ' A' ' 37' ' ' PRO . 16.0 m-20 -65.07 -44.74 87.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.414 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -68.96 -19.08 64.16 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.863 0.363 . . . . 0.0 111.201 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.84 -23.68 23.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.547 -178.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.625 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.0 mt -69.03 158.69 34.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.136 178.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -70.78 149.08 47.23 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.414 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -59.99 -31.64 70.11 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -172.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.01 -37.83 93.53 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.118 177.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 96.8 mt-30 -66.72 -49.04 67.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 177.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.83 -40.91 96.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.413 178.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.414 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 45.7 ttm -61.54 -33.77 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.785 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -81.19 -28.69 34.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.857 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 58.2 mtpt -64.18 -39.14 93.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.094 0.473 . . . . 0.0 110.291 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -113.46 43.39 1.77 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.64 178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -48.3 -37.71 17.07 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -116.72 13.53 15.16 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.346 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -121.91 25.13 9.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.352 0.596 . . . . 0.0 109.491 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.758 HD12 HG22 ' A' ' 29' ' ' ILE . 10.2 tt -130.14 139.12 52.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.688 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.7 t -127.76 123.81 61.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 91' ' ' SER . 58.6 mt -94.83 103.06 14.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.459 HG11 ' HB1' ' A' ' 92' ' ' ALA . 29.1 m -84.1 144.77 9.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.048 0.451 . . . . 0.0 111.329 -175.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.19 122.57 6.36 Favored Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.649 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.519 HD11 ' HB1' ' A' ' 28' ' ' ALA . 63.4 mt -95.25 -4.03 46.47 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.778 0.34 . . . . 0.0 110.536 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 m -59.26 -24.68 63.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.489 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -76.69 -38.58 54.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.49 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.9 mt -106.68 100.14 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.996 0.427 . . . . 0.0 110.887 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -80.23 8.36 7.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.148 0.499 . . . . 0.0 110.7 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -104.02 12.51 34.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.838 -177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.5 HG21 HD21 ' A' ' 62' ' ' LEU . 5.3 p -81.84 26.03 0.52 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -70.2 -36.63 74.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.868 0.366 . . . . 0.0 111.301 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.63 6.05 29.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.252 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.505 HD13 HD11 ' A' ' 77' ' ' ILE . 14.3 tp -71.54 115.83 11.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.944 0.402 . . . . 0.0 110.079 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 43.3 tttm -100.9 140.86 34.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.512 -174.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 74.1 mtt180 -72.78 152.53 41.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.283 173.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.29 41.39 38.24 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.696 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -143.24 -166.05 2.22 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.497 ' HG3' ' HB2' ' A' ' 100' ' ' LEU . 63.1 pttt -144.28 145.45 32.03 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' A' ' 99' ' ' LEU . 25.5 pt -135.47 152.08 31.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.268 0.556 . . . . 0.0 111.313 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -104.8 106.71 17.32 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.844 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.41 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 30.7 m -103.92 155.58 5.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.881 0.372 . . . . 0.0 111.434 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.473 ' HB3' ' HE3' ' A' ' 13' ' ' MET . 6.6 m-90 -113.43 111.59 22.21 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.432 172.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 2.4 p90 -115.43 163.66 15.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.36 -175.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.34 -60.84 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -93.45 133.4 36.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.152 0.501 . . . . 0.0 111.547 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -115.91 117.11 29.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.365 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.716 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 67.2 mttm -85.97 135.28 33.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.962 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -92.6 42.52 1.1 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.995 -173.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.9 t -68.65 -31.84 71.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.843 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 48.6 t30 64.39 102.38 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.428 0 O-C-N 123.611 0.569 . . . . 0.0 110.705 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.403 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 27.2 Cg_exo -63.18 152.12 69.66 Favored 'Cis proline' 0 C--N 1.347 0.452 0 C-N-CA 124.076 -1.218 . . . . 0.0 113.022 2.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 45.6 Cg_exo -55.95 130.1 38.52 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.015 2.477 . . . . 0.0 112.275 -178.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.716 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 13.3 m -105.44 116.06 31.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.082 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.459 ' HB1' HG11 ' A' ' 60' ' ' VAL . . . -104.09 116.05 31.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.731 0.3 . . . . 0.0 111.215 -176.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.1 m -76.88 114.6 15.84 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.9 pt -96.65 139.04 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.915 0.388 . . . . 0.0 111.192 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -104.81 -25.87 12.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.786 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -147.72 163.64 36.06 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.639 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 2.6 p90 -162.01 150.35 15.0 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.989 0.423 . . . . 0.0 111.572 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -114.75 123.09 48.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.763 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.519 ' HA ' HG21 ' A' ' 77' ' ' ILE . 43.7 tp -75.32 110.97 10.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.088 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.497 ' HB2' ' HG3' ' A' ' 76' ' ' LYS . 86.3 mt -91.49 107.26 19.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.105 0.479 . . . . 0.0 110.679 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.7 mt -90.55 145.35 24.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.649 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.452 ' OE1' ' HE2' ' A' ' 76' ' ' LYS . 10.3 mm-40 -86.71 -43.52 12.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.948 -175.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -98.95 133.61 42.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.759 0.314 . . . . 0.0 110.173 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -132.36 133.46 43.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.857 -177.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -85.07 170.99 12.41 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.924 0.392 . . . . 0.0 110.556 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -86.87 -7.8 57.87 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.24 0.543 . . . . 0.0 110.091 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -99.79 18.81 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 171.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 55.1 p-80 . . . . . 0 C--O 1.249 1.036 0 CA-C-N 114.163 -1.381 . . . . 0.0 112.387 -179.508 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.412 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 82.4 mtp . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -91.29 1.49 57.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.008 0.432 . . . . 0.0 110.733 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -96.88 -3.81 41.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.698 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.412 ' OD1' ' HB2' ' A' ' 1' ' ' MET . 18.2 m120 -70.29 -55.04 10.19 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.438 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -108.06 118.97 38.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.64 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -76.55 100.49 5.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.031 0.444 . . . . 0.0 110.788 -174.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -68.16 126.23 28.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.653 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -145.2 -165.11 11.04 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 111.574 -0.611 . . . . 0.0 111.574 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -70.47 117.4 11.96 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -53.43 -62.33 1.72 Allowed 'General case' 0 C--O 1.234 0.288 0 O-C-N 123.877 0.736 . . . . 0.0 110.965 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 m -79.18 105.97 10.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.57 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -72.12 113.49 9.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 0.0 109.952 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.471 ' HB2' ' HB3' ' A' ' 80' ' ' TRP . 61.5 mtm -86.78 164.36 16.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.594 -173.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -83.2 126.81 33.04 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.675 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.2 m -91.61 132.12 36.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.891 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.445 HD11 HG22 ' A' ' 32' ' ' THR . 0.2 OUTLIER -137.26 130.3 30.68 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.399 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.22 126.41 52.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.68 169.15 29.23 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.218 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.48 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 87.7 m-85 -103.25 135.51 44.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.849 0.357 . . . . 0.0 110.769 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.77 96.18 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.046 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.5 t -96.11 -53.32 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.608 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.825 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 92.8 mt -116.5 136.19 53.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.977 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -126.88 130.18 49.67 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.209 0.528 . . . . 0.0 111.01 -178.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.38 175.53 5.47 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -74.49 -34.33 63.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -119.23 -0.32 11.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.579 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -143.18 165.29 27.84 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 -175.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.418 ' HB3' ' CG2' ' A' ' 60' ' ' VAL . . . -138.89 122.31 17.21 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.859 0.362 . . . . 0.0 110.074 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.825 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 53.6 mt -90.9 99.33 9.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.243 0.544 . . . . 0.0 109.637 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.7 mt -108.94 139.08 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.711 -173.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.3 mt -87.67 114.21 26.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.445 HG22 HD11 ' A' ' 16' ' ' LEU . 6.0 p -80.08 -16.19 55.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.05 119.42 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.447 HG23 ' HE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -80.56 69.85 7.15 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -171.186 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -128.99 120.31 25.82 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 168.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -67.15 114.12 16.87 Favored Pre-proline 0 C--N 1.327 -0.377 0 O-C-N 123.109 0.256 . . . . 0.0 110.799 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 11.4 Cg_exo -70.92 156.99 59.34 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 123.016 2.477 . . . . 0.0 112.158 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.22 -178.09 34.46 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.769 178.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -58.25 -38.51 77.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.905 0.383 . . . . 0.0 110.746 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.448 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.6 mp0 -60.93 -40.44 93.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.474 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -72.92 -34.73 66.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.542 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -72.9 -20.08 61.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.613 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -82.1 -26.14 33.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.032 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.0 mt -61.96 145.17 53.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.5 m -88.32 -179.83 6.2 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.999 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.48 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 23.7 mp0 -54.24 -61.48 2.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.57 -172.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.23 -34.2 83.43 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.536 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.38 -41.26 89.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.838 0.352 . . . . 0.0 110.287 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.2 -33.36 65.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.657 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.566 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 66.1 mtt -64.4 -24.42 67.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.415 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -90.35 -31.5 16.87 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.5 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -78.37 -38.9 40.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.184 0.516 . . . . 0.0 110.261 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -113.59 55.39 0.72 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.566 ' HA ' ' O ' ' A' ' 50' ' ' MET . 20.8 tttt -61.38 112.67 2.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.469 -171.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 65.45 11.68 7.56 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.786 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -107.9 9.08 28.82 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.771 0.796 . . . . 0.0 109.199 174.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.548 HD11 HG22 ' A' ' 29' ' ' ILE . 18.8 tt -123.99 132.52 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.117 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.496 HG23 ' HB2' ' A' ' 90' ' ' PRO . 98.7 t -120.07 125.85 74.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.994 0.426 . . . . 0.0 110.981 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.426 HD12 ' HE2' ' A' ' 50' ' ' MET . 56.4 mt -91.85 96.43 6.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.418 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.0 m -76.01 147.54 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.211 0.529 . . . . 0.0 110.704 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.87 119.87 6.14 Favored Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.769 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.501 HD12 HG21 ' A' ' 68' ' ' THR . 64.6 mt -89.1 27.08 1.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -38.25 80.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.371 -176.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.691 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 26.0 mm-40 -92.72 -9.38 40.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.687 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.408 HD11 ' CD1' ' A' ' 97' ' ' TYR . 50.2 mt -117.36 104.64 16.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.044 0.449 . . . . 0.0 111.008 -175.26 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -82.23 -38.59 24.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.731 -178.115 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -81.01 47.99 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.446 0.641 . . . . 0.0 111.252 -175.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.501 HG21 HD12 ' A' ' 62' ' ' LEU . 2.2 p -85.36 18.39 2.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.573 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -73.99 -24.74 59.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.576 174.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.14 -26.33 65.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.928 174.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -83.42 121.48 27.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.494 ' HZ1' ' HB2' ' A' ' 72' ' ' LYS . 9.1 mtmp? -119.29 165.53 14.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.903 0.382 . . . . 0.0 110.821 -179.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -83.76 127.42 33.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.81 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.74 42.48 2.47 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.068 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -134.06 -171.15 2.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.177 0.513 . . . . 0.0 111.455 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.48 ' HD2' ' CE2' ' A' ' 19' ' ' TYR . 83.6 tttt -138.69 129.52 26.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.107 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 pt -136.74 166.65 25.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.663 0.744 . . . . 0.0 112.586 -175.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.498 ' HB2' HD11 ' A' ' 100' ' ' LEU . 55.8 tttt -122.56 106.98 11.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.309 177.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.497 ' HB ' HG22 ' A' ' 94' ' ' ILE . 30.1 m -98.41 149.34 5.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 120.988 0.423 . . . . 0.0 112.139 -171.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.471 ' HB3' ' HB2' ' A' ' 13' ' ' MET . 5.6 m-90 -114.53 106.23 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.393 172.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.437 ' HB3' HG21 ' A' ' 94' ' ' ILE . 30.8 p90 -108.97 135.31 50.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.32 0.581 . . . . 0.0 111.106 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -91.61 -48.9 6.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.449 ' CG2' ' HB ' ' A' ' 93' ' ' THR . 8.6 t -104.68 126.64 51.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.281 0.562 . . . . 0.0 110.243 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -112.39 138.46 49.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.164 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.655 ' HB2' ' HB3' ' A' ' 91' ' ' SER . 58.9 mttm -118.04 134.28 55.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.0 0.428 . . . . 0.0 110.379 -178.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -110.02 56.5 0.62 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.485 0.659 . . . . 0.0 109.544 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 p -73.23 -23.36 60.35 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.53 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 63.87 99.78 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.629 0 C-N-CA 123.252 0.621 . . . . 0.0 111.293 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 34.0 Cg_endo -63.73 147.22 63.4 Favored 'Cis proline' 0 C--N 1.349 0.564 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.585 1.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.496 ' HB2' HG23 ' A' ' 58' ' ' VAL . 34.8 Cg_exo -57.14 152.67 43.45 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.03 2.486 . . . . 0.0 113.082 -176.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.655 ' HB3' ' HB2' ' A' ' 85' ' ' LYS . 26.3 t -134.81 161.06 36.26 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.357 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.26 110.08 2.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.618 0.246 . . . . 0.0 110.599 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.449 ' HB ' ' CG2' ' A' ' 83' ' ' THR . 38.5 m -73.89 113.64 11.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.912 0.387 . . . . 0.0 110.09 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.497 HG22 ' HB ' ' A' ' 79' ' ' VAL . 31.8 pt -100.03 138.4 24.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.008 -177.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.691 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 39.7 mt-30 -104.85 -10.87 17.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.246 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -159.74 144.16 14.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.491 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.408 ' CD1' HD11 ' A' ' 65' ' ' ILE . 5.1 p90 -147.59 152.73 38.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.015 0.435 . . . . 0.0 111.12 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -114.56 144.17 43.81 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.092 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 51.2 tp -93.25 136.62 33.35 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 -178.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.6 mt -123.69 90.95 3.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.772 0.32 . . . . 0.0 110.182 178.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.01 147.67 29.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.932 0.396 . . . . 0.0 111.375 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.05 -43.62 98.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.401 177.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -99.42 114.97 28.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.158 -178.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -94.1 -17.07 23.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.763 -177.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -115.36 107.27 15.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -78.22 98.17 5.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.883 -172.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -98.0 -45.48 6.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.842 -1.169 . . . . 0.0 107.842 168.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 . . . . . 0 C--O 1.245 0.854 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.363 174.387 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.1 mtm . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 120.836 0.351 . . . . 0.0 110.394 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -87.53 122.5 31.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -83.47 -14.21 52.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.753 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -88.63 173.18 8.77 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.808 0.337 . . . . 0.0 110.277 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.24 131.4 34.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.001 0.429 . . . . 0.0 110.063 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -82.51 -36.29 26.56 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.607 -178.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.9 t30 50.67 44.25 27.61 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.926 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.8 161.68 39.7 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.521 -177.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -62.43 156.12 23.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.485 0.183 . . . . 0.0 110.615 -178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 65.49 43.28 3.44 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -171.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.9 m -63.1 112.09 2.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.195 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -75.99 111.51 11.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.725 175.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.455 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 67.5 mtm -85.38 150.78 24.5 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.644 -176.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -83.85 125.89 32.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.707 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.5 t -109.55 141.16 42.44 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.378 -173.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.415 ' O ' ' HA ' ' A' ' 78' ' ' LYS . 67.9 mt -139.41 146.82 40.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.276 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.7 t -97.08 127.96 48.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 171.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 157.47 27.31 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.819 -176.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -94.66 125.51 39.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.465 -0.368 . . . . 0.0 110.308 -177.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.51 104.73 11.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.452 HG11 HD21 ' A' ' 49' ' ' LEU . 7.1 p -100.66 -42.04 9.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.861 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.725 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 66.8 mt -129.34 154.81 46.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.644 0.259 . . . . 0.0 110.42 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -148.44 142.11 25.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.09 0.471 . . . . 0.0 111.171 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.458 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 13.8 t70 -123.14 -155.72 0.67 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 171.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.458 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 6.9 t30 -102.76 -31.3 10.39 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -91.66 -35.61 14.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.92 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -135.88 165.64 25.16 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.171 -174.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.37 149.69 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.751 174.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.725 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 42.0 mt -106.41 111.55 35.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.957 0.408 . . . . 0.0 110.488 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.76 141.94 44.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.462 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.3 mt -106.71 118.79 55.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.3 p -79.65 120.66 24.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.231 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 60.82 -162.43 0.27 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.665 0.603 . . . . 0.0 110.379 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m 76.94 14.26 2.06 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.314 174.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 62.96 -174.62 0.15 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.356 -178.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.414 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -84.09 135.42 42.12 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.292 178.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 32.2 Cg_exo -58.9 158.47 24.76 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.903 2.402 . . . . 0.0 112.452 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.5 174.08 55.15 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.266 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -62.07 -39.84 93.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.519 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.9 mp0 -65.05 -34.14 77.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.326 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -64.64 -36.6 84.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.698 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -75.57 -5.02 43.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.02 0.438 . . . . 0.0 111.042 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.415 HD21 ' HA ' ' A' ' 43' ' ' ASN . 10.3 m120 -109.16 -8.24 15.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.65 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.1 mt -76.34 148.48 37.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 175.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -75.69 165.05 25.63 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.669 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -55.09 -47.45 74.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.537 -173.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.02 93.73 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.608 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.86 -44.82 96.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 0.0 110.624 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.452 HD21 HG11 ' A' ' 21' ' ' VAL . 25.1 tp -62.78 -43.94 97.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.724 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 87.3 mtp -64.68 -22.98 67.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.428 -179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -93.49 -9.56 37.98 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.54 -50.7 5.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.998 0.427 . . . . 0.0 110.339 179.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -102.55 40.07 1.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -57.83 -29.78 65.21 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.897 -169.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -93.94 -23.76 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -109.41 11.42 25.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.745 0.307 . . . . 0.0 111.615 -175.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.7 tt -91.65 125.04 44.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.3 0.571 . . . . 0.0 110.722 179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.0 t -118.84 120.43 64.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.942 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 91' ' ' SER . 66.1 mt -92.43 101.88 13.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.202 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -86.22 140.1 16.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.226 0.536 . . . . 0.0 111.236 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -92.17 125.89 8.28 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.292 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.471 HD21 HG22 ' A' ' 68' ' ' THR . 63.2 mt -94.44 14.43 20.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.091 0.472 . . . . 0.0 110.531 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -60.08 -28.46 67.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.845 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 17.3 mm-40 -89.39 -3.44 58.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.442 -176.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 26.5 mt -119.58 117.67 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.105 0.479 . . . . 0.0 110.249 -177.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -86.12 7.83 23.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.403 0.621 . . . . 0.0 111.136 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -153.94 83.77 1.15 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.168 -176.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.471 HG22 HD21 ' A' ' 62' ' ' LEU . 1.2 p -119.77 13.16 12.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.445 0.64 . . . . 0.0 110.614 177.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -72.98 -9.12 58.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.764 -175.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -92.68 5.86 49.51 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.081 -0.387 . . . . 0.0 111.049 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.7 tp -90.57 140.85 29.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.221 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.478 ' HD3' ' CD ' ' A' ' 75' ' ' GLU . 6.6 mptt -124.58 -178.52 4.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -93.17 123.23 36.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.052 174.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.61 42.69 2.11 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.556 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.478 ' CD ' ' HD3' ' A' ' 72' ' ' LYS . 53.9 mt-10 -128.3 177.84 6.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.896 0.379 . . . . 0.0 110.947 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -121.05 135.19 55.25 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.446 HG21 ' HA ' ' A' ' 99' ' ' LEU . 33.2 pt -137.62 152.99 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.334 0.588 . . . . 0.0 111.483 177.167 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 82.8 tttt -110.2 107.28 17.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.605 176.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.707 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.3 m -95.17 154.65 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -170.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.455 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 12.7 m-90 -125.78 123.38 38.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.636 172.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.498 ' HB3' HG21 ' A' ' 94' ' ' ILE . 55.5 p90 -140.07 171.35 14.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.003 0.43 . . . . 0.0 111.089 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 62.8 t60 -147.27 -35.8 0.23 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.494 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.586 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 2.5 m -76.47 98.78 4.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.063 175.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.0 ttt180 -94.73 120.95 35.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.406 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -119.8 139.35 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -121.57 101.62 7.72 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.464 -0.495 . . . . 0.0 110.864 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.5 t -104.8 -11.66 16.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.311 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 65.65 99.51 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 O-C-N 124.078 0.861 . . . . 0.0 109.675 -174.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -72.28 171.4 63.33 Favored 'Cis proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.004 -1.248 . . . . 0.0 113.227 3.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.73 140.61 84.7 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.02 2.48 . . . . 0.0 112.798 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.8 p -130.04 115.75 17.56 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.417 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.4 125.05 50.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.764 0.316 . . . . 0.0 110.884 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.586 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 24.3 m -84.62 107.56 16.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.498 HG21 ' HB3' ' A' ' 81' ' ' PHE . 31.0 pt -96.44 139.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.113 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -103.14 -5.32 23.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.539 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -173.26 151.34 2.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.734 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -143.84 163.4 33.49 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.61 120.99 42.06 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.446 ' HA ' HG21 ' A' ' 77' ' ' ILE . 37.0 tp -75.24 109.71 8.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.961 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.602 HD23 ' HB2' ' A' ' 107' ' ' HIS . 43.5 mt -82.27 84.0 7.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.066 0.46 . . . . 0.0 110.533 -176.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.6 mt -63.67 132.14 50.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.688 175.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.51 28.49 0.47 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.161 0.505 . . . . 0.0 111.45 -170.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.68 -26.21 23.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -135.12 130.71 35.89 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 170.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -81.65 -8.83 59.75 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.785 0.326 . . . . 0.0 111.609 -169.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -127.75 110.46 12.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 110.044 174.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . 0.602 ' HB2' HD23 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -93.53 156.76 16.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.157 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 9.4 p80 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 177.666 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.431 ' HG2' ' OD1' ' A' ' 4' ' ' ASN . 57.6 ttp . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -98.91 -52.37 3.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.379 -175.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -71.33 -29.51 65.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.718 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.431 ' OD1' ' HG2' ' A' ' 1' ' ' MET . 88.7 m-20 64.82 14.53 9.25 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.477 0.485 . . . . 0.0 111.36 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.425 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 10.6 tp10 -98.97 145.97 26.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.328 -177.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -56.98 -48.44 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.857 -173.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -55.92 108.17 0.42 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.905 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.35 47.7 89.79 Favored Glycine 0 N--CA 1.449 -0.465 0 CA-C-N 115.621 -0.718 . . . . 0.0 113.347 174.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' HB2' ' O ' ' A' ' 5' ' ' GLU . 1.1 t70 -98.57 -162.75 0.98 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.99 -68.42 0.39 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.724 0.297 . . . . 0.0 111.64 -176.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.3 m -107.47 137.5 45.4 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.127 -176.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.05 116.52 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.506 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 53.1 mtp -107.83 119.02 38.26 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.885 0.374 . . . . 0.0 110.495 -177.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.409 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 13.4 mp0 -83.79 161.63 20.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.055 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 m -102.85 128.66 49.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 0.0 111.45 -175.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.612 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 4.7 tt -116.7 109.5 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.8 t -93.9 117.78 38.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 158.69 27.77 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.473 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -96.25 127.82 42.61 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.0 t -75.92 97.3 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -103.4 -37.5 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -176.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.725 HD22 HD12 ' A' ' 29' ' ' ILE . 36.8 tp -136.26 126.69 26.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.512 ' HE3' ' HB2' ' A' ' 71' ' ' LEU . 62.4 tttm -146.46 125.54 12.88 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.664 -177.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -70.41 0.57 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.106 0.479 . . . . 0.0 110.245 176.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -154.68 -60.59 0.12 Allowed 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -97.61 -20.2 17.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.928 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 27' ' ' ARG . 19.8 mtm180 -104.13 123.88 48.08 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.967 0.413 . . . . 0.0 110.954 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.497 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -111.05 112.92 25.08 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.956 176.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.725 HD12 HD22 ' A' ' 22' ' ' LEU . 54.1 mt -86.03 109.46 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.473 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.22 143.01 42.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.688 -175.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.9 mt -104.97 123.0 58.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -76.78 101.23 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.548 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.3 t70 64.28 101.77 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.812 0.695 . . . . 0.0 111.364 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.15 -7.24 4.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.36 40.2 29.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -174.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.25 102.84 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.289 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.503 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -50.72 -63.52 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.186 2.591 . . . . 0.0 112.849 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.7 148.69 5.44 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.757 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -61.21 -37.71 83.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.477 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.8 -26.64 44.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.5 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.541 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 2.3 m-20 -65.41 -32.2 73.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.762 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -69.66 -14.19 62.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.918 0.389 . . . . 0.0 110.63 176.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -99.6 -18.07 17.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.541 ' HG ' ' HA ' ' A' ' 41' ' ' ASP . 87.6 mt -63.26 149.91 44.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.029 0.442 . . . . 0.0 110.989 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -76.25 171.26 14.83 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.871 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 50' ' ' MET . 41.9 tt0 -56.27 -54.62 43.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.346 -176.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.03 -37.5 91.67 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.469 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -65.28 -43.37 91.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.984 0.421 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.5 mt -68.23 -40.02 82.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.948 177.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.436 ' HE2' ' HG3' ' A' ' 89' ' ' PRO . 85.5 mtp -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.998 -177.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.59 -34.12 14.15 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.974 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -76.66 -43.9 36.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.057 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -110.09 39.82 2.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.871 0.844 . . . . 0.0 109.107 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.411 ' O ' HG21 ' A' ' 57' ' ' ILE . 26.7 ttpt -53.93 -48.64 70.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.723 -170.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -86.51 0.52 54.1 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -175.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -124.98 17.99 8.5 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.709 -176.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.417 HG23 ' HB3' ' A' ' 89' ' ' PRO . 13.6 tt -103.36 124.14 57.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.193 0.521 . . . . 0.0 111.74 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.504 HG21 ' HG2' ' A' ' 90' ' ' PRO . 70.1 t -124.33 137.54 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.301 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.66 HD13 HG12 ' A' ' 29' ' ' ILE . 13.3 mm -104.2 100.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.142 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' A' ' 28' ' ' ALA . 34.3 m -89.01 139.95 16.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.257 0.551 . . . . 0.0 111.046 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -94.36 117.2 5.47 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.948 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.526 ' HB3' HG22 ' A' ' 68' ' ' THR . 49.0 mt -95.75 11.03 34.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.626 0.37 . . . . 0.0 110.562 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.1 m -63.93 -14.83 56.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.45 ' OE2' ' HG2' ' A' ' 95' ' ' GLN . 27.5 tt0 -96.72 -3.33 42.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.21 0.529 . . . . 0.0 110.418 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.45 ' CG2' HG23 ' A' ' 68' ' ' THR . 31.1 mt -113.23 109.92 30.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.91 11.36 9.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.814 -168.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -136.9 24.01 3.07 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 122.207 -0.308 . . . . 0.0 111.763 -177.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.526 HG22 ' HB3' ' A' ' 62' ' ' LEU . 1.7 p -80.43 37.73 0.41 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.78 -21.22 25.24 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.046 0.451 . . . . 0.0 110.623 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -73.95 -17.73 60.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.976 -174.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.512 ' HB2' ' HE3' ' A' ' 23' ' ' LYS . 3.2 mm? -71.31 122.79 20.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.745 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -108.01 171.19 7.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.424 -179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -86.4 117.9 25.5 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.43 33.56 2.68 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.759 -177.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.63 -177.48 4.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -135.13 135.0 40.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 -175.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.515 HG22 ' HA ' ' A' ' 99' ' ' LEU . 32.1 pt -137.93 151.45 25.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.432 0.634 . . . . 0.0 111.7 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.432 ' HD3' ' OE2' ' A' ' 98' ' ' GLU . 47.9 tttm -115.33 106.75 14.38 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.541 172.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.432 ' CG2' ' HB3' ' A' ' 16' ' ' LEU . 30.1 m -100.77 154.15 4.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.323 -174.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.2 m-90 -104.81 119.46 39.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.642 174.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.612 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -136.79 171.99 13.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -164.57 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.465 -0.789 . . . . 0.0 108.892 175.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.405 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 0.2 OUTLIER -75.3 90.68 2.63 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.991 174.506 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 84' ' ' ARG . 23.0 ttt180 -108.45 117.84 35.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.131 0.491 . . . . 0.0 110.787 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -112.47 94.51 4.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.399 -0.819 . . . . 0.0 108.839 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.794 ' HG3' ' HB3' ' A' ' 90' ' ' PRO . 27.3 tt0 -85.47 109.71 18.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.362 0.601 . . . . 0.0 111.283 -173.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p -108.68 -11.63 15.05 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.583 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.0 t30 62.01 96.18 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.354 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.433 -173.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.436 ' HG3' ' HE2' ' A' ' 50' ' ' MET . 39.4 Cg_endo -66.63 144.1 66.91 Favored 'Cis proline' 0 C--N 1.344 0.317 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.677 1.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.794 ' HB3' ' HG3' ' A' ' 86' ' ' GLU . 41.4 Cg_endo -68.7 139.87 45.3 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.715 2.277 . . . . 0.0 112.656 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 29.8 t -111.28 153.45 25.9 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.21 131.18 19.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.682 0.277 . . . . 0.0 111.074 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.405 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 11.9 m -85.91 126.89 34.43 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG21 ' HB3' ' A' ' 81' ' ' PHE . 31.3 pt -117.47 153.04 19.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.519 -178.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.473 ' HB2' ' HE1' ' A' ' 13' ' ' MET . 80.0 mt-30 -110.6 -38.17 5.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.035 176.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -130.8 150.91 51.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.736 -172.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 1.7 p90 -152.07 154.1 35.27 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 0.0 110.712 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.432 ' OE2' ' HD3' ' A' ' 78' ' ' LYS . 42.0 mt-10 -117.21 114.34 23.51 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.502 175.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.515 ' HA ' HG22 ' A' ' 77' ' ' ILE . 65.1 tp -71.38 104.41 3.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.411 HD13 ' HB2' ' A' ' 78' ' ' LYS . 73.1 mt -78.71 90.97 4.62 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.7 tp -66.49 93.33 0.23 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.965 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.409 ' OE1' ' HB2' ' A' ' 104' ' ' HIS . 2.6 tm-20 -57.34 116.76 3.51 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -80.25 21.08 0.62 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -166.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.409 ' HB2' ' OE1' ' A' ' 102' ' ' GLU . 57.4 m80 -128.67 -58.54 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.334 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 22.0 m80 61.21 -166.4 0.21 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 -173.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.92 56.61 1.66 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.536 0.684 . . . . 0.0 110.024 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -145.48 7.83 1.15 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.065 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 65.1 t60 . . . . . 0 C--O 1.25 1.083 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.768 -172.542 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.583 0.23 . . . . 0.0 110.587 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 134.32 56.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.939 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.411 ' HD3' ' HA ' ' A' ' 3' ' ' LYS . 11.0 mmtm -88.41 146.86 25.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.019 0.437 . . . . 0.0 110.886 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.569 ' OD1' ' HE3' ' A' ' 12' ' ' LYS . 33.8 t30 -117.05 127.05 53.78 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.788 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -93.39 -2.15 55.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.152 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -103.61 145.7 29.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.027 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -96.38 91.97 6.09 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 159.29 57.16 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 -175.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.23 -21.49 64.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.112 -0.544 . . . . 0.0 110.917 -174.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.05 -31.47 72.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.933 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -72.16 -19.94 61.68 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.348 0.594 . . . . 0.0 110.491 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.569 ' HE3' ' OD1' ' A' ' 4' ' ' ASN . 68.0 mttm -88.36 112.7 23.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.39 0.614 . . . . 0.0 110.652 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.491 ' HE1' ' HB3' ' A' ' 80' ' ' TRP . 69.3 mtp -111.21 140.33 45.86 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.135 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -83.84 119.56 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.321 -177.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.9 t -83.59 109.89 17.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 -178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.484 HD11 HG21 ' A' ' 32' ' ' THR . 3.2 tm? -116.52 119.31 35.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.693 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.443 HG21 ' HG3' ' A' ' 78' ' ' LYS . 30.5 t -94.08 129.65 44.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 162.8 28.93 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.656 -176.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -100.89 126.46 47.51 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.71 91.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.705 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.465 HG22 ' CE1' ' A' ' 42' ' ' TYR . 2.9 p -93.15 -39.48 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.674 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.727 HD21 HD13 ' A' ' 29' ' ' ILE . 39.8 tp -130.27 133.01 46.18 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -131.37 137.47 48.74 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.827 0.346 . . . . 0.0 110.338 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.16 -176.98 3.24 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.22 -37.68 52.84 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -94.54 -37.31 11.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.782 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -137.56 174.75 10.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.983 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -145.89 149.24 33.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.511 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.727 HD13 HD21 ' A' ' 22' ' ' LEU . 42.3 mt -106.25 115.92 48.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.078 178.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.0 mt -110.09 138.48 46.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.404 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.8 mt -95.21 118.51 41.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.484 HG21 HD11 ' A' ' 16' ' ' LEU . 14.5 p -79.93 89.7 5.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.226 -174.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.49 ' C ' ' HG1' ' A' ' 34' ' ' THR . 38.5 t70 55.5 86.91 0.05 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.442 171.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.49 ' HG1' ' C ' ' A' ' 33' ' ' ASP . 2.9 m -148.44 31.63 0.81 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.521 0.677 . . . . 0.0 110.064 178.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 63.91 28.05 14.5 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.269 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.44 150.9 0.11 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.67 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.459 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 95.3 Cg_endo -81.26 161.41 20.17 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.205 1.937 . . . . 0.0 111.559 173.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.86 173.29 30.52 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.145 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -58.78 -28.43 65.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.278 0.561 . . . . 0.0 109.714 177.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.59 -38.85 75.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.89 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.459 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 54.6 m-20 -81.17 -28.34 35.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.37 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . 0.465 ' CE1' HG22 ' A' ' 21' ' ' VAL . 91.7 m-85 -74.02 -18.88 60.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.129 0.49 . . . . 0.0 109.841 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -80.43 -37.21 32.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.177 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.401 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 78.8 mt -64.1 162.0 15.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.27 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.9 m -81.54 162.97 22.97 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -32.96 72.52 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.292 -173.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.78 -41.55 93.58 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.14 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.401 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 93.7 mt-30 -66.73 -38.01 85.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 110.193 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.8 tp -68.66 -40.66 80.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.008 175.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.524 ' HG3' HD13 ' A' ' 57' ' ' ILE . 47.9 ttm -61.54 -29.42 69.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -81.74 -35.14 30.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.97 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -71.98 -52.26 17.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.919 0.39 . . . . 0.0 110.683 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -95.35 46.39 1.11 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.515 0.674 . . . . 0.0 109.321 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.1 tttp -53.37 -35.08 59.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.362 -1.29 . . . . 0.0 113.247 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -109.04 1.31 20.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -120.71 7.16 10.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.608 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.524 HD13 ' HG3' ' A' ' 50' ' ' MET . 10.9 tt -93.43 123.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.968 -179.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.25 129.36 73.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.281 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.421 HG12 HG12 ' A' ' 29' ' ' ILE . 59.7 mt -95.57 108.2 20.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.834 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.77 142.98 12.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.262 0.553 . . . . 0.0 111.326 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.31 115.99 4.51 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.816 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.485 HD22 HG21 ' A' ' 68' ' ' THR . 69.8 mt -105.18 -4.8 21.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.735 0.303 . . . . 0.0 110.665 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.5 m -62.98 -29.21 70.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.321 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -90.65 9.56 29.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.121 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.45 HD12 HG13 ' A' ' 94' ' ' ILE . 58.2 mt -137.72 95.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 174.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -75.16 -9.66 58.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -176.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -89.81 33.5 0.85 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.641 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.485 HG21 HD22 ' A' ' 62' ' ' LEU . 8.0 p -101.93 21.17 15.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.131 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -80.6 -31.26 36.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.522 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -74.16 -10.57 59.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.583 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.4 tp -71.87 119.82 16.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.919 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -99.39 144.46 28.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.507 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -77.63 133.01 38.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.75 48.29 3.7 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -175.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.434 ' HG2' HD11 ' A' ' 99' ' ' LEU . 6.0 tp10 -140.98 171.44 14.07 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -116.19 139.19 50.6 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.519 HG21 ' HA ' ' A' ' 99' ' ' LEU . 33.1 pt -139.36 154.68 25.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.27 0.557 . . . . 0.0 111.587 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HG3' HG21 ' A' ' 17' ' ' VAL . 38.4 ttpt -116.58 107.0 14.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.168 -0.923 . . . . 0.0 108.899 174.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.499 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 25.3 m -96.85 158.96 3.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.042 0.449 . . . . 0.0 111.59 -173.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.491 ' HB3' ' HE1' ' A' ' 13' ' ' MET . 3.3 m-90 -126.39 122.02 34.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.225 173.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -133.28 158.1 43.78 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.183 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -112.72 -12.19 13.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.06 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.9 m -141.11 137.18 32.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.165 -176.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.2 mtm-85 -112.38 140.48 47.06 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 174.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.764 ' HB3' ' HB2' ' A' ' 91' ' ' SER . 82.6 tttt -84.44 117.68 23.8 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 104.43 1.72 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.362 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.8 p -162.09 176.36 10.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.356 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -134.17 110.57 11.79 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.698 175.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -71.36 156.25 96.84 Favored 'Cis proline' 0 C--O 1.235 0.368 0 C-N-CA 123.772 -1.345 . . . . 0.0 112.609 -0.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.7 138.79 87.7 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.703 2.268 . . . . 0.0 112.149 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.764 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 21.6 m -112.54 158.32 20.08 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.273 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -150.79 101.38 2.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.887 0.375 . . . . 0.0 111.289 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 27.4 m -71.19 115.54 10.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.45 HG13 HD12 ' A' ' 65' ' ' ILE . 37.7 pt -89.8 154.24 3.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.261 0.553 . . . . 0.0 111.736 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -104.76 -23.0 13.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.203 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.45 ' HG2' ' N ' ' A' ' 97' ' ' TYR . 51.6 tttt -162.32 159.56 25.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.318 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.499 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 30.2 p90 -148.89 157.67 43.6 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 175.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -114.48 116.25 28.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.74 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . 0.519 ' HA ' HG21 ' A' ' 77' ' ' ILE . 43.7 tp -72.48 108.76 5.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.937 179.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.7 mt -98.6 101.69 13.19 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 76.5 mt -61.58 119.73 9.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.867 -177.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.87 117.25 4.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.097 176.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -115.83 117.54 30.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.962 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.34 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.008 0.432 . . . . 0.0 109.951 175.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.25 98.28 5.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.941 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -86.6 -16.21 37.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.011 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -128.41 145.31 51.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.19 177.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.97 179.331 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.832 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.7 ' H ' ' HG3' ' A' ' 1' ' ' MET . 18.4 m120 -63.77 146.52 53.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.068 0.461 . . . . 0.0 110.647 -179.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -88.27 159.26 18.19 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.581 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -81.14 -33.39 33.21 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.516 ' HG2' ' H ' ' A' ' 7' ' ' ASN . 36.5 tt0 -80.19 140.63 36.23 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -83.37 -2.02 54.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.986 0.422 . . . . 0.0 110.812 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.516 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 79.9 m-20 -118.75 176.14 5.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.69 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 68.79 26.91 74.26 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.472 -177.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.06 -36.66 82.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.835 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -74.29 -29.0 61.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.865 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -61.62 108.07 0.92 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.118 -179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -111.54 115.14 28.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.528 ' HE2' ' HD2' ' A' ' 96' ' ' LYS . 61.3 mtm -128.96 146.66 50.91 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -87.14 116.77 25.43 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.623 ' HB3' ' CD1' ' A' ' 80' ' ' TRP . 17.8 p -94.15 133.85 37.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.728 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.75 130.86 38.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.602 176.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -93.74 133.11 35.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.195 179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -155.66 167.64 33.14 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.301 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -97.0 134.08 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.635 0.255 . . . . 0.0 110.776 178.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.2 t -83.64 106.36 14.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 25.5 m -104.34 -34.8 3.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.882 0.372 . . . . 0.0 111.552 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 84.8 mt -135.82 140.38 44.19 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -136.42 119.26 16.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.431 0.634 . . . . 0.0 111.901 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 18.7 t70 -97.54 176.33 5.9 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 170.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -64.21 -38.77 92.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.653 0.264 . . . . 0.0 110.453 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -107.65 -41.31 5.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.692 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 51.1 mtm-85 -104.2 115.8 31.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.108 0.48 . . . . 0.0 112.215 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.438 ' HB2' HD13 ' A' ' 62' ' ' LEU . . . -100.96 121.97 42.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.873 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 67.6 mt -91.3 110.83 22.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.011 -178.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 mt -109.87 147.34 33.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.749 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.6 mt -104.8 113.34 41.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.149 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.2 p -90.65 -19.18 23.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.621 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.539 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 34.2 t70 -65.99 119.49 11.44 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 172.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.5 m -75.85 85.96 2.82 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.788 0.804 . . . . 0.0 112.07 -170.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -140.23 136.58 33.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.592 -1.186 . . . . 0.0 108.635 172.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.13 118.2 65.1 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -78.81 115.61 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.603 2.202 . . . . 0.0 111.431 178.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 -163.66 25.18 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.774 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.36 -44.17 79.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.547 0.213 . . . . 0.0 111.206 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -67.78 -32.75 73.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.821 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -65.47 -36.76 84.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.125 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -85.72 -6.13 59.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -88.03 -26.49 22.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 110.319 176.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.33 147.54 47.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.212 177.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 57.3 p -75.67 161.53 29.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.348 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -53.17 -41.86 65.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.559 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.11 -53.15 48.1 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.491 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.91 -37.22 86.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.101 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.6 tp -61.23 -44.34 97.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.327 0.584 . . . . 0.0 109.849 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 51.9 ttm -70.86 -20.41 62.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.074 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.31 -38.63 63.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.197 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -79.61 -48.9 13.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.888 0.375 . . . . 0.0 110.94 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -91.27 23.67 3.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.837 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 84.3 tttt -50.16 -42.26 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -171.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -98.45 12.1 36.1 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.539 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 16.0 t-20 -154.49 34.44 0.41 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.322 0.582 . . . . 0.0 111.19 -177.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.6 tt -119.8 132.43 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.5 t -121.47 125.35 73.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 0.0 111.391 -174.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.8 mt -101.35 114.87 41.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 27.1 m -98.89 145.16 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.187 0.518 . . . . 0.0 111.373 -176.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -95.14 114.22 4.8 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.045 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.53 HD11 ' HB ' ' A' ' 68' ' ' THR . 42.4 mt -87.06 4.77 40.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.048 0.451 . . . . 0.0 109.914 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -56.84 -37.24 70.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.51 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -85.23 -7.21 59.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 0.0 110.997 -178.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.9 mt -94.53 -39.24 10.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.681 176.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 76.08 -37.98 0.32 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.351 172.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -130.27 87.83 2.56 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.385 0.612 . . . . 0.0 109.658 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.53 ' HB ' HD11 ' A' ' 62' ' ' LEU . 4.0 m -119.62 24.58 10.54 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 174.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -18.36 52.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.541 -1.663 . . . . 0.0 113.202 -172.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -66.67 -27.5 67.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.922 0.391 . . . . 0.0 110.606 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.619 HD23 HG23 ' A' ' 77' ' ' ILE . 3.6 mp -73.81 145.29 45.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.342 0.591 . . . . 0.0 111.8 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -119.47 157.88 27.38 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.197 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 73' ' ' ARG . 7.9 ptt180 -76.94 71.7 3.46 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.105 0.955 . . . . 0.0 110.768 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 162.48 48.7 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -138.06 -173.88 3.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.187 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -126.98 124.75 40.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.757 -176.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.619 HG23 HD23 ' A' ' 71' ' ' LEU . 42.8 pt -136.34 166.85 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.644 0.735 . . . . 0.0 112.43 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -131.31 106.94 8.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.46 -1.245 . . . . 0.0 108.562 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.4 m -95.86 150.73 4.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.623 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 5.4 m-90 -116.11 118.31 32.5 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.736 173.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.5 ' HB3' HG23 ' A' ' 94' ' ' ILE . 19.0 p90 -124.77 176.62 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.105 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -93.71 -43.14 8.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.927 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -162.76 177.85 8.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.456 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -123.68 136.0 54.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.914 0.388 . . . . 0.0 111.0 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -99.13 97.65 8.74 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.494 ' HG2' ' HG3' ' A' ' 90' ' ' PRO . 1.5 tm-20 -87.36 87.89 7.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.256 0.551 . . . . 0.0 110.141 -174.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.5 p -108.02 2.89 23.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.251 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 27.1 t-20 60.18 101.11 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.364 -177.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.429 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 73.9 Cg_endo -75.98 152.38 96.6 Favored 'Cis proline' 0 CA--C 1.53 0.325 0 C-N-CA 123.29 -1.546 . . . . 0.0 112.658 -0.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.494 ' HG3' ' HG2' ' A' ' 86' ' ' GLU . 31.9 Cg_exo -59.09 120.54 8.46 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.646 2.231 . . . . 0.0 112.003 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.6 m -105.69 142.69 34.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.635 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.51 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -142.37 121.79 13.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.85 0.357 . . . . 0.0 111.443 -177.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.6 m -81.49 110.05 16.53 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.5 HG23 ' HB3' ' A' ' 81' ' ' PHE . 37.8 pt -96.43 155.49 3.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.608 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.35 -29.43 5.5 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.464 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.528 ' HD2' ' HE2' ' A' ' 13' ' ' MET . 79.2 mttt -135.03 155.17 51.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.885 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -153.7 148.1 26.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.178 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.448 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 34.3 tt0 -114.69 119.71 37.65 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 53.6 tp -78.6 119.5 21.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.504 -177.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 98.1 mt -103.65 80.86 1.83 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.132 0.491 . . . . 0.0 110.367 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.9 tp -72.8 128.3 35.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.375 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -35.58 80.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.097 0.475 . . . . 0.0 110.696 -175.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.72 81.43 8.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.243 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -77.21 71.0 3.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.965 0.412 . . . . 0.0 110.027 177.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 57.8 m170 -120.03 -44.62 2.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.604 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -83.6 66.03 8.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.727 0.775 . . . . 0.0 111.868 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -114.66 8.57 16.28 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 162.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 32.1 m80 . . . . . 0 C--O 1.247 0.949 0 CA-C-N 113.504 -1.68 . . . . 0.0 108.136 -178.686 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.7 mtt . . . . . 0 N--CA 1.484 1.254 0 CA-C-O 121.111 0.481 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -114.52 -165.68 1.04 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -87.13 -15.42 38.47 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.349 0.595 . . . . 0.0 110.372 176.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -125.01 106.36 9.89 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 174.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -91.22 160.15 15.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.791 0.805 . . . . 0.0 112.493 -170.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -92.77 102.91 15.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.225 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -65.98 151.73 46.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.09 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -82.41 56.57 5.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.676 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -167.23 149.04 5.87 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.74 -28.78 60.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.841 0.353 . . . . 0.0 110.777 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.4 p -87.85 -170.1 2.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 63.8 29.66 14.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.368 0.604 . . . . 0.0 109.892 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.456 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 75.6 mtm -76.72 143.37 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.04 175.414 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -83.63 116.78 22.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -175.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 10.8 t -107.94 139.5 42.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.013 -169.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.424 HD13 ' C ' ' A' ' 15' ' ' SER . 6.0 mp -138.47 163.32 32.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.298 174.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -95.71 140.42 17.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 136.84 6.09 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.055 -1.069 . . . . 0.0 112.468 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -90.25 124.47 34.9 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.966 0.412 . . . . 0.0 110.115 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG21 HD11 ' A' ' 71' ' ' LEU . 13.9 t -82.01 104.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.983 -177.269 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.508 HG21 HD21 ' A' ' 49' ' ' LEU . 15.9 m -100.98 -41.28 8.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.177 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.683 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.1 mt -130.23 146.1 51.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 110.515 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -132.85 123.54 26.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.314 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.423 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 67.6 m-20 -101.33 -2.91 29.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 174.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 t30 75.63 -55.59 0.62 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.478 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.71 -18.91 50.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.599 0.714 . . . . 0.0 109.186 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 14.7 mtm180 -135.16 159.74 40.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.802 175.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.508 ' HB3' HD12 ' A' ' 62' ' ' LEU . . . -134.75 127.61 31.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.055 0.455 . . . . 0.0 110.518 175.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.683 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 56.9 mt -95.4 101.53 12.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.423 HD23 HG23 ' A' ' 20' ' ' VAL . 32.4 mt -115.05 140.91 48.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.124 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -90.67 111.47 23.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -83.2 -9.34 59.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.306 0.574 . . . . 0.0 110.979 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -90.38 157.58 17.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.324 176.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.9 p -89.53 3.44 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -172.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.42 93.92 4.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 109.898 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.97 128.1 92.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.413 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 96.3 Cg_endo -78.94 -178.93 5.01 Favored 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 123.008 2.472 . . . . 0.0 112.671 -178.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.66 -176.37 20.62 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.521 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -68.38 -23.12 64.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.968 0.414 . . . . 0.0 110.637 -177.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.3 mp0 -70.81 -38.41 73.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.377 177.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.413 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 7.8 m-20 -65.17 -38.54 90.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.491 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -65.94 -19.03 65.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.889 0.376 . . . . 0.0 111.018 175.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.43 -20.48 23.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.939 178.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.403 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 99.2 mt -74.76 153.37 38.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 177.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.2 p -77.68 168.68 19.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.496 ' HG3' HD12 ' A' ' 22' ' ' LEU . 1.6 mp0 -53.77 -42.65 68.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.77 178.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.53 -49.33 70.24 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.222 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.403 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 77.9 mm-40 -64.11 -43.52 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.928 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 21' ' ' VAL . 29.1 tp -64.31 -47.23 80.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.245 -177.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' HD12 ' A' ' 59' ' ' ILE . 68.3 mtm -75.82 -13.36 60.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.484 -177.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -89.07 -35.44 16.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.086 0.47 . . . . 0.0 110.295 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -73.38 -49.22 28.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.349 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.58 47.12 0.93 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -59.12 121.02 10.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.794 -172.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 69.35 4.83 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.041 -0.981 . . . . 0.0 112.358 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -104.83 5.59 33.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.585 0.707 . . . . 0.0 109.281 173.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.598 HD12 HG21 ' A' ' 29' ' ' ILE . 19.4 tt -126.04 140.14 49.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.697 -176.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -122.53 129.07 75.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.124 0.488 . . . . 0.0 111.086 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.448 HD12 ' SD ' ' A' ' 50' ' ' MET . 60.4 mt -94.91 107.76 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 175.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.472 ' CG2' ' HB2' ' A' ' 28' ' ' ALA . 33.5 m -88.91 145.2 7.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.255 0.55 . . . . 0.0 111.032 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.13 115.19 4.53 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.346 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.512 HD13 HG21 ' A' ' 68' ' ' THR . 87.2 mt -94.98 21.48 7.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.005 0.431 . . . . 0.0 110.307 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 27.2 p -60.6 -25.79 66.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.333 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -87.45 -9.31 54.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.011 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.425 HD13 ' HA ' ' A' ' 96' ' ' LYS . 47.7 mt -128.32 105.59 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.23 -177.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -81.66 -11.85 58.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.707 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -116.04 82.07 1.71 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.547 0.689 . . . . 0.0 109.813 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.512 HG21 HD13 ' A' ' 62' ' ' LEU . 38.4 p -111.14 17.68 20.11 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.219 -0.901 . . . . 0.0 108.606 174.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.88 -27.32 69.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.341 -1.3 . . . . 0.0 111.306 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.73 -23.48 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.065 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.475 HD11 HG21 ' A' ' 20' ' ' VAL . 23.9 tp -65.19 131.7 47.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -117.76 172.8 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.228 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 73' ' ' ARG . 23.8 mtm180 -98.0 137.56 36.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.809 0.338 . . . . 0.0 110.31 176.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.33 23.33 22.19 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -116.97 -173.12 2.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.075 0.464 . . . . 0.0 111.404 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.486 ' HG2' HD11 ' A' ' 100' ' ' LEU . 78.3 tttt -141.82 123.21 14.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.972 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 pt -130.98 168.9 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.388 0.613 . . . . 0.0 112.004 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -116.48 117.84 31.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.08 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.564 ' O ' ' HA ' ' A' ' 15' ' ' SER . 26.8 m -104.29 148.69 8.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.505 ' CD1' ' HB2' ' A' ' 15' ' ' SER . 6.8 m-90 -125.67 116.76 22.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.148 175.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.493 ' HB3' HG21 ' A' ' 94' ' ' ILE . 30.1 p90 -126.05 167.6 15.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 0.0 111.886 177.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.71 29.66 2.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.075 177.028 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -172.29 148.22 2.08 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.617 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -149.5 139.39 21.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -113.43 141.67 46.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.141 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.25 47.47 1.34 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.852 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.9 p -64.85 -37.82 88.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 55.57 93.95 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 O-C-N 123.875 0.735 . . . . 0.0 111.764 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 38.7 Cg_exo -60.98 135.38 14.62 Favored 'Cis proline' 0 C--N 1.354 0.824 0 C-N-CA 124.163 -1.182 . . . . 0.0 112.788 3.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 36.9 Cg_exo -59.43 141.45 97.53 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.125 2.55 . . . . 0.0 113.009 -175.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.0 p -116.22 151.09 36.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.89 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.34 119.15 9.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.741 0.305 . . . . 0.0 110.808 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 45.6 m -78.55 110.72 13.9 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.366 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.493 HG21 ' HB3' ' A' ' 81' ' ' PHE . 41.1 pt -96.13 143.76 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.659 -178.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -93.07 -28.81 16.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.615 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.425 ' HA ' HD13 ' A' ' 65' ' ' ILE . 67.8 mttm -150.89 159.58 44.46 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.339 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -147.65 147.6 30.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.595 176.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.498 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 28.0 tt0 -114.42 136.88 52.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.185 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.31 120.83 25.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.486 HD11 ' HG2' ' A' ' 76' ' ' LYS . 92.9 mt -89.6 118.46 29.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.047 0.451 . . . . 0.0 110.209 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.83 84.23 6.94 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.344 -178.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.52 108.43 4.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.106 178.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -76.25 -34.12 59.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -141.7 107.74 5.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.051 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -63.32 117.35 6.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -78.93 100.62 7.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.94 -173.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -80.73 128.45 33.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.11 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 31.7 m170 . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.824 176.897 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.454 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 93.5 m-20 -86.36 121.97 29.67 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 175.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -53.16 -53.53 49.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.269 -174.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.414 ' ND2' ' HB2' ' A' ' 6' ' ' GLN . 43.5 t30 -85.83 118.16 25.15 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.96 -31.11 64.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.426 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.414 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 96.0 mt-30 -62.95 -27.82 69.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.708 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.48 -4.14 25.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.442 0.639 . . . . 0.0 109.704 177.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.454 ' HA2' ' HB2' ' A' ' 2' ' ' ASN . . . -74.45 178.92 44.11 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.689 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -92.76 139.9 30.07 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.897 0.38 . . . . 0.0 110.646 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -107.3 -71.46 0.75 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 175.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 m -84.82 103.92 14.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.61 116.57 8.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.077 0.465 . . . . 0.0 111.399 -176.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.1 mtp -92.2 124.11 36.04 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.453 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.6 mt-30 -83.66 125.27 31.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.173 0.511 . . . . 0.0 110.442 -171.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.2 m -100.81 134.47 43.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.809 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.509 HD13 ' CE2' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -117.75 124.37 48.3 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 174.297 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.1 t -94.52 117.87 39.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.87 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.61 167.37 29.21 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.85 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.44 146.14 26.66 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.9 t -101.23 108.44 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.44 HG21 ' HG2' ' A' ' 37' ' ' PRO . 47.0 t -101.17 -59.66 3.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.856 0.36 . . . . 0.0 110.821 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.684 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 85.6 mt -116.65 159.51 22.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.405 -175.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -143.95 124.22 13.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.621 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 8.1 t70 -77.92 -66.4 0.85 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.124 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 49.3 t30 163.72 -60.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.662 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -90.62 -17.09 27.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.827 -1.078 . . . . 0.0 109.68 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -124.77 151.07 45.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.493 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.495 ' HB1' HD12 ' A' ' 62' ' ' LEU . . . -122.73 138.61 54.57 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.17 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.684 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 73.3 mt -99.05 104.08 15.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.913 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.8 mt -112.63 156.44 22.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.712 -172.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -106.39 109.0 26.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.229 171.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.0 p -83.84 72.55 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.8 0.809 . . . . 0.0 109.763 177.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.45 ' CG ' ' H ' ' A' ' 34' ' ' THR . 10.2 t70 -157.34 -167.36 2.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.606 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.45 ' H ' ' CG ' ' A' ' 33' ' ' ASP . 6.5 t -110.63 -11.98 14.38 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.952 -178.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.68 132.43 46.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.057 0.456 . . . . 0.0 111.652 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.37 115.87 65.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.265 177.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.44 ' HG2' HG21 ' A' ' 21' ' ' VAL . 18.1 Cg_exo -66.63 146.17 78.36 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.819 2.346 . . . . 0.0 112.169 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.77 -179.36 31.98 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.667 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.51 -40.07 81.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.849 0.357 . . . . 0.0 110.864 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.53 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.8 tt0 -64.3 -31.57 72.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -72.03 -35.03 69.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.833 0.349 . . . . 0.0 110.363 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.73 -25.07 61.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.063 0.459 . . . . 0.0 109.896 174.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -75.37 -27.91 59.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.139 176.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 95.7 mt -65.96 155.84 35.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.247 176.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.8 p -90.53 174.07 7.73 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.411 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.81 -50.96 55.16 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 123.41 0.444 . . . . 0.0 111.821 -176.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.62 -42.5 99.69 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.619 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -65.71 -39.1 90.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 0.0 110.254 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.31 -44.68 94.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.145 176.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.67 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 76.2 mtp -67.84 -18.35 64.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.967 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -91.56 -21.36 20.89 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.745 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -86.12 -51.32 6.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.328 0.585 . . . . 0.0 109.733 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -96.23 49.64 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.67 ' HA ' ' O ' ' A' ' 50' ' ' MET . 33.6 tttp -53.65 118.21 3.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.522 -170.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 64.89 10.34 6.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.584 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -106.31 15.26 26.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.753 0.787 . . . . 0.0 109.278 175.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.56 HD11 HG21 ' A' ' 29' ' ' ILE . 8.8 tt -107.97 135.53 46.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.335 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 90' ' ' PRO . 74.6 t -126.76 131.66 70.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.854 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 91' ' ' SER . 72.2 mt -97.24 109.14 22.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 175.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.512 HG13 ' HB1' ' A' ' 92' ' ' ALA . 29.0 m -93.09 140.99 15.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.295 0.569 . . . . 0.0 111.318 -177.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.63 118.65 5.29 Favored Glycine 0 N--CA 1.442 -0.965 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.36 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD13 HG21 ' A' ' 68' ' ' THR . 11.0 mt -99.26 17.78 19.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.3 p -65.59 -14.23 60.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.685 -176.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -86.45 -12.45 49.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.004 0.43 . . . . 0.0 110.325 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 30.5 mm -117.65 108.8 25.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.893 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -91.98 16.53 10.92 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.468 0.651 . . . . 0.0 110.004 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -134.22 31.44 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.019 -176.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.498 HG21 HD13 ' A' ' 62' ' ' LEU . 1.7 m -86.45 44.13 1.12 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.378 0.609 . . . . 0.0 111.861 -171.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.57 -23.54 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.543 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -83.58 5.59 23.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.105 0.479 . . . . 0.0 111.074 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.454 HD13 ' CE2' ' A' ' 97' ' ' TYR . 9.9 tt -97.52 115.82 28.55 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -100.18 -172.36 2.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.399 0.618 . . . . 0.0 111.354 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -96.82 141.52 29.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.19 168.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.45 31.27 28.04 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.818 176.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -119.08 -168.01 1.49 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.932 0.396 . . . . 0.0 110.419 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -138.38 134.59 34.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.7 pt -135.63 158.33 39.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 112.421 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -117.64 106.77 13.45 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.932 173.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 19.1 m -100.65 148.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.95 0.405 . . . . 0.0 111.866 -172.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.497 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 7.9 m-90 -106.23 104.92 14.72 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.331 173.381 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.509 ' CE2' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -107.21 159.08 16.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.057 -177.456 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -112.38 -30.97 6.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.771 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -134.57 127.17 30.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.973 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -119.25 123.61 44.69 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 174.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -125.1 121.03 33.09 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.621 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.79 83.6 7.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.939 0.4 . . . . 0.0 110.313 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -84.24 -13.77 51.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.833 175.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.12 92.72 0.06 OUTLIER Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.151 -178.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -67.96 143.64 69.78 Favored 'Cis proline' 0 C--N 1.346 0.421 0 C-N-CA 123.836 -1.318 . . . . 0.0 112.768 2.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.506 ' HB2' HG21 ' A' ' 58' ' ' VAL . 31.7 Cg_exo -58.22 142.7 97.47 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.715 2.277 . . . . 0.0 112.327 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.415 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 15.5 m -122.82 156.63 34.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.637 179.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.512 ' HB1' HG13 ' A' ' 60' ' ' VAL . . . -146.47 136.36 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.558 0.218 . . . . 0.0 110.879 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.5 m -94.41 114.7 26.77 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.486 HG21 ' HB3' ' A' ' 81' ' ' PHE . 2.8 pp -104.11 142.0 18.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.782 -177.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -105.22 -9.56 17.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.753 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.27 147.6 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.454 ' CE2' HD13 ' A' ' 71' ' ' LEU . 4.7 p90 -134.07 146.67 50.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 0.0 110.703 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.497 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 33.2 tt0 -116.24 126.45 53.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.812 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 39.6 tp -75.97 135.92 40.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.31 0.576 . . . . 0.0 111.4 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.422 HD21 ' CD2' ' A' ' 104' ' ' HIS . 58.3 mt -112.72 105.67 13.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.2 mt -60.03 -30.15 68.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.726 -174.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.895 ' HG2' ' HD2' ' A' ' 103' ' ' HIS . 43.7 tt0 -141.83 -78.74 0.25 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 175.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . 0.895 ' HD2' ' HG2' ' A' ' 102' ' ' GLU . 6.8 p80 -171.73 160.77 5.78 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . 0.422 ' CD2' HD21 ' A' ' 100' ' ' LEU . 22.2 m-70 -114.13 96.0 5.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.144 0.497 . . . . 0.0 110.295 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -91.52 120.2 32.13 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.499 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -106.2 160.06 15.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.268 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -111.89 179.82 3.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 42.2 m80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.056 179.546 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtm . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 67.37 176.06 0.25 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 122.067 0.937 . . . . 0.0 113.158 171.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -175.76 -53.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.775 -1.557 . . . . 0.0 106.972 173.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -89.87 135.28 33.73 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.569 165.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.428 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 45.1 mm-40 -54.86 -43.61 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.474 HE22 ' HE1' ' A' ' 13' ' ' MET . 88.5 mt-30 -84.58 15.58 3.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.948 0.404 . . . . 0.0 111.743 -173.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -113.4 20.13 16.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.293 0.568 . . . . 0.0 110.025 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 177.5 54.52 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.955 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HB3' ' O ' ' A' ' 5' ' ' GLU . 5.7 t70 -172.15 -37.0 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.656 0.741 . . . . 0.0 109.31 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 71.82 17.3 5.4 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.793 168.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -81.07 113.12 19.05 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 170.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -99.21 153.5 18.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.095 0.474 . . . . 0.0 110.727 -178.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.497 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 76.7 mtm -109.74 151.0 27.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.372 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -88.56 139.11 30.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.577 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.6 t -88.88 124.5 34.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.963 0.411 . . . . 0.0 110.887 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.36 125.49 42.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.869 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 60.7 t -105.33 120.9 56.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 174.47 28.26 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.432 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -102.07 136.62 41.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.44 HG21 HD21 ' A' ' 30' ' ' LEU . 11.4 t -91.6 102.7 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.725 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 m -100.21 -35.58 4.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.499 -178.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.875 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 70.1 mt -129.72 138.52 51.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -176.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -148.73 127.92 12.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.8 175.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.26 -80.68 0.53 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.773 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -144.4 -66.57 0.34 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -89.94 -18.76 25.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.135 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -119.97 140.21 51.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.492 0.663 . . . . 0.0 112.048 -172.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' A' ' 62' ' ' LEU . . . -121.62 117.74 27.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.156 172.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.875 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 47.5 mt -88.63 105.91 16.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.752 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.44 HD21 HG21 ' A' ' 20' ' ' VAL . 20.8 mt -106.42 157.61 17.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.966 -176.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.9 mt -103.48 120.55 53.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -31.81 68.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.195 0.521 . . . . 0.0 110.787 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.54 130.31 35.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.194 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.2 p -75.94 79.06 2.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.421 0.629 . . . . 0.0 111.169 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -144.95 144.85 31.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.199 -176.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.74 119.58 69.46 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.77 -71.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.906 2.404 . . . . 0.0 112.822 -175.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.43 166.72 14.51 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.433 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.07 -41.2 97.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.957 0.408 . . . . 0.0 110.358 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.69 -37.1 81.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.509 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.62 -34.82 77.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.389 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -73.84 -12.07 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.48 177.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -93.15 -23.82 18.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.023 0.44 . . . . 0.0 110.221 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.9 mt -70.51 152.9 43.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.882 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -71.62 155.78 40.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.201 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.434 ' HG3' HD23 ' A' ' 22' ' ' LEU . 1.8 mp0 -51.14 -49.68 60.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.363 0.414 . . . . 0.0 111.118 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.09 81.39 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.936 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.43 -38.94 74.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.021 0.439 . . . . 0.0 110.232 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.69 -38.33 80.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.175 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 82.8 mtp -63.41 -33.48 75.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.634 177.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -70.11 -38.31 75.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.812 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.82 -52.25 18.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.857 -177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -96.1 37.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.837 0.351 . . . . 0.0 110.579 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -43.44 -49.51 7.14 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -172.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -108.58 8.38 27.11 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.22 16.22 13.16 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.838 0.351 . . . . 0.0 110.227 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.446 ' O ' ' HD2' ' A' ' 90' ' ' PRO . 8.0 tt -126.42 146.54 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.322 -174.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.507 HG23 ' HB2' ' A' ' 90' ' ' PRO . 59.5 t -134.53 120.8 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.054 0.454 . . . . 0.0 110.446 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.1 mt -89.79 105.47 16.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.707 177.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.422 HG12 ' HB2' ' A' ' 92' ' ' ALA . 33.8 m -87.25 146.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.354 0.597 . . . . 0.0 111.271 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -91.4 117.69 5.25 Favored Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.816 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.521 ' HB3' HG23 ' A' ' 68' ' ' THR . 85.9 mt -95.1 7.26 46.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.764 0.426 . . . . 0.0 110.009 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 p -57.75 -30.61 65.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.712 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -73.45 -35.17 65.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.494 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.513 ' HB ' HG21 ' A' ' 68' ' ' THR . 36.1 mt -104.76 99.23 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.28 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.37 -21.01 63.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.538 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -97.57 37.43 1.37 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.514 0.674 . . . . 0.0 110.885 -176.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.521 HG23 ' HB3' ' A' ' 62' ' ' LEU . 1.0 OUTLIER -83.39 16.28 2.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.929 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -67.23 -20.48 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.201 0.524 . . . . 0.0 110.455 178.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.96 -21.09 65.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.628 178.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.41 HD12 HD12 ' A' ' 77' ' ' ILE . 13.3 tp -76.91 144.49 38.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.318 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -132.5 -172.47 2.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.402 -174.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 73' ' ' ARG . 19.0 mtp180 -100.86 129.57 46.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 173.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.41 33.82 6.99 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.053 -0.594 . . . . 0.0 111.879 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.56 163.45 12.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.014 0.435 . . . . 0.0 111.296 -175.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -120.7 112.62 19.09 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 170.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.41 HD12 HD12 ' A' ' 71' ' ' LEU . 42.0 pt -125.16 151.88 31.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.453 0.644 . . . . 0.0 111.899 -176.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.412 ' HE3' ' CH2' ' A' ' 80' ' ' TRP . 35.8 ttpt -107.99 107.42 18.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.881 175.255 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 34.3 m -100.25 157.98 3.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.016 0.436 . . . . 0.0 111.472 -174.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.497 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 11.0 m-90 -124.62 129.64 50.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.047 175.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.505 ' HB3' HG21 ' A' ' 94' ' ' ILE . 4.4 p90 -151.09 161.82 42.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.585 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -128.49 -35.67 1.93 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.1 m -93.88 106.24 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.649 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -103.87 133.31 49.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.396 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -112.69 93.87 4.64 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.518 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 43.2 tt0 -92.77 89.61 6.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.219 0.533 . . . . 0.0 110.218 -177.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -103.23 -3.65 25.41 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.267 -175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 63.43 97.3 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.435 0 O-C-N 123.755 0.66 . . . . 0.0 110.535 -175.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . 0.418 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 57.1 Cg_endo -70.28 150.18 91.03 Favored 'Cis proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.533 -1.445 . . . . 0.0 112.897 1.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.518 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.0 Cg_exo -61.13 146.3 97.76 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.024 2.483 . . . . 0.0 112.633 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.7 m -132.29 157.92 43.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.929 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.422 ' HB2' HG12 ' A' ' 60' ' ' VAL . . . -147.2 122.27 10.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.602 0.239 . . . . 0.0 111.224 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.4 m -84.23 110.56 18.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.505 HG21 ' HB3' ' A' ' 81' ' ' PHE . 41.5 pt -101.24 141.52 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.264 -174.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.494 ' HB2' ' SD ' ' A' ' 13' ' ' MET . 95.7 mt-30 -96.75 -21.29 17.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.627 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.494 ' HA ' HD12 ' A' ' 65' ' ' ILE . 57.8 tttm -158.31 146.02 18.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.539 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.8 p90 -128.0 174.71 8.96 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -143.59 118.71 10.1 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.4 tp -73.46 127.8 33.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.481 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.2 mt -100.48 139.95 35.43 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.2 mt -79.63 13.67 1.97 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.023 0.44 . . . . 0.0 111.497 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -85.57 64.92 8.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.874 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -82.52 -57.4 3.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.493 0.663 . . . . 0.0 109.277 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -93.57 96.38 9.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.272 177.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -72.78 158.05 36.31 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.405 -175.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -118.2 136.82 53.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.056 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 t-160 -77.11 -32.77 56.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.571 176.216 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.904 0.383 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -84.53 -32.15 24.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.807 177.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -94.76 -165.04 1.24 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.563 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -104.31 -17.15 14.94 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -173.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -65.62 107.18 1.65 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -79.14 98.79 6.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.23 0.538 . . . . 0.0 110.27 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -119.76 162.17 19.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.768 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.67 -143.79 3.58 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.215 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -130.91 136.4 48.57 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.32 -34.83 79.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.166 0.508 . . . . 0.0 110.377 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.6 m -79.14 94.38 5.36 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -72.24 104.52 3.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.583 177.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 71.2 mtp -87.62 107.52 18.65 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.999 -174.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -100.63 125.49 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.599 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 60.0 p -92.52 149.56 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.283 0.564 . . . . 0.0 112.0 -174.485 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -146.74 131.47 17.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.181 175.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.4 t -98.18 126.32 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 158.79 27.8 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.416 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -84.8 124.2 31.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 -178.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.401 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 15.0 t -81.68 107.95 14.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.466 HG12 ' HG2' ' A' ' 37' ' ' PRO . 27.1 m -114.99 -41.29 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.737 0.303 . . . . 0.0 111.665 -176.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.715 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 71.7 mt -120.94 144.72 48.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 68' ' ' THR . 48.4 tttm -148.36 132.04 16.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 0.0 111.65 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -111.82 -165.19 0.97 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 169.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -90.19 -25.92 20.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.426 0.631 . . . . 0.0 109.542 174.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -94.15 -32.48 13.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.645 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -143.9 161.48 38.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 0.0 111.048 -171.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.465 ' HB3' HD13 ' A' ' 62' ' ' LEU . . . -134.63 127.35 31.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.711 173.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.715 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 37.6 mt -93.83 111.21 24.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -177.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 23.8 mt -112.42 148.96 33.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.689 -174.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.2 mt -98.49 119.29 46.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 174.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 p -85.76 -14.37 45.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.141 0.495 . . . . 0.0 110.793 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -75.7 163.15 27.59 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.5 p -89.48 -11.85 41.76 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -76.69 105.58 7.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 0.0 110.695 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.98 137.58 61.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.209 176.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.466 ' HG2' HG12 ' A' ' 21' ' ' VAL . 24.1 Cg_exo -63.61 151.5 84.77 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.087 2.524 . . . . 0.0 112.62 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.98 -175.62 39.49 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.932 177.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -51.75 -53.34 40.76 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.831 0.453 . . . . 0.0 111.621 -178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.468 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 4.2 mp0 -67.97 -26.82 66.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.342 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -69.89 -35.23 74.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.678 0.275 . . . . 0.0 110.775 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -72.37 -18.44 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.962 0.41 . . . . 0.0 110.526 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.05 -22.09 25.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 98.9 mt -63.9 151.53 42.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.4 p -75.23 163.13 27.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.976 0.417 . . . . 0.0 111.109 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -53.35 -45.64 69.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.319 -177.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.88 -47.0 93.41 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.577 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -61.57 -40.21 93.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.682 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.48 -43.27 97.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.389 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.4 ' HE1' HD11 ' A' ' 59' ' ' ILE . 66.0 mtt -66.64 -24.65 66.33 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.239 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -85.76 -35.91 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.274 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -73.04 -37.67 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.911 0.386 . . . . 0.0 110.652 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -107.68 39.2 1.97 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.229 0.538 . . . . 0.0 109.906 176.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -52.85 121.72 7.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.936 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.5 t30 73.84 -7.47 1.59 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.844 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.404 HD21 ' HA ' ' A' ' 56' ' ' ASN . 11.5 m120 -109.48 15.81 22.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.572 0.701 . . . . 0.0 110.106 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 21.0 tt -126.63 130.2 71.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.016 179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.487 HG21 ' HG2' ' A' ' 90' ' ' PRO . 95.2 t -115.44 128.83 72.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -172.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.4 HD11 ' HE1' ' A' ' 50' ' ' MET . 57.4 mt -94.34 101.94 13.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.631 176.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.6 m -80.99 145.94 8.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.102 0.477 . . . . 0.0 110.639 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 114.54 4.32 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.308 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.465 HD13 ' HB3' ' A' ' 28' ' ' ALA . 89.3 mt -98.76 13.74 31.22 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 177.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.0 t -61.48 -22.21 64.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.196 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -106.36 4.21 28.31 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.002 0.429 . . . . 0.0 110.709 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.8 mt -116.54 117.19 54.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.022 0.439 . . . . 0.0 110.608 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -92.14 -32.79 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 111.056 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -80.7 43.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.593 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . 0.507 ' O ' ' HE3' ' A' ' 23' ' ' LYS . 69.0 p -87.1 10.84 15.4 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 122.12 -0.363 . . . . 0.0 110.699 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.38 -36.09 60.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.849 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.37 -13.5 52.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.0 110.0 176.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.59 ' HB2' ' HH ' ' A' ' 97' ' ' TYR . 55.2 tp -79.28 100.74 7.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.654 175.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -106.22 148.12 28.29 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.598 -174.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' A' ' 21' ' ' VAL . 15.4 ptt180 -91.52 152.35 20.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.906 0.384 . . . . 0.0 110.238 177.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.87 25.67 8.37 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -169.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.01 -164.44 2.02 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.972 0.415 . . . . 0.0 111.132 -173.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.421 ' HB2' ' HZ3' ' A' ' 76' ' ' LYS . 5.6 mtmp? -131.47 141.55 49.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.243 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.8 pt -134.2 148.95 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.991 0.424 . . . . 0.0 110.945 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.453 ' HB2' HD13 ' A' ' 100' ' ' LEU . 50.0 tttp -103.31 106.83 17.44 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 175.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.1 m -97.17 147.09 6.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.498 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TRP . . . . . 0.452 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 16.0 m-90 -112.48 109.79 19.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.759 173.266 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.443 ' HB3' HG23 ' A' ' 94' ' ' ILE . 14.2 p90 -120.8 179.27 4.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -142.54 -38.72 0.36 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.36 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.5 m -110.41 121.72 45.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.68 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -108.87 132.97 53.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.24 0.543 . . . . 0.0 110.21 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -99.7 124.11 44.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.233 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -79.95 50.54 1.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.066 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -71.91 -29.29 64.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.585 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.4 t30 60.77 99.09 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 O-C-N 123.812 0.695 . . . . 0.0 111.268 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.83 153.31 79.86 Favored 'Cis proline' 0 C--N 1.344 0.341 0 C-N-CA 123.579 -1.425 . . . . 0.0 112.764 1.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.487 ' HG2' HG21 ' A' ' 58' ' ' VAL . 12.5 Cg_endo -56.16 138.81 84.3 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.918 2.412 . . . . 0.0 112.536 -177.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.8 t -118.35 137.88 52.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.435 178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -128.38 102.83 6.83 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.867 0.365 . . . . 0.0 111.077 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.9 m -68.99 112.23 5.49 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.463 HG21 ' HB ' ' A' ' 79' ' ' VAL . 34.4 pt -106.19 147.88 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.018 0.437 . . . . 0.0 111.022 -175.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -111.1 -25.29 9.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.44 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -142.16 137.56 30.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.251 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.59 ' HH ' ' HB2' ' A' ' 71' ' ' LEU . 26.1 p90 -140.03 153.6 46.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.92 178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.452 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 40.8 tt0 -114.9 128.76 56.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.815 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.89 105.85 10.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.384 -178.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.453 HD13 ' HB2' ' A' ' 78' ' ' LYS . 84.0 mt -85.07 78.57 9.86 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.62 125.78 25.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.334 -175.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -89.21 160.15 17.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.084 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -85.19 -32.9 22.43 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 171.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -81.61 106.11 13.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.711 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -126.93 147.29 50.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.974 176.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -85.95 5.78 31.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.201 0.524 . . . . 0.0 110.166 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -143.35 131.86 22.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.762 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 33.3 m80 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.062 176.205 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.6 mtp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -83.73 115.16 22.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.029 0.442 . . . . 0.0 109.988 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.0 p -97.44 130.47 44.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.251 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -130.27 130.14 44.17 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.412 ' N ' HD13 ' A' ' 16' ' ' LEU . 50.8 t -95.54 123.51 47.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.22 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 176.61 27.29 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.706 -177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -101.24 134.84 43.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.66 0.267 . . . . 0.0 110.734 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 t -87.27 109.47 19.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.85 -36.76 4.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.103 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.737 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 89.6 mt -133.32 141.58 48.03 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -141.42 130.92 23.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.096 0.474 . . . . 0.0 111.624 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -115.83 -146.44 0.4 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 170.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -100.65 -55.73 2.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.029 0.377 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -90.46 -6.74 54.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.578 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -151.1 155.03 38.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.053 0.454 . . . . 0.0 111.437 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -141.72 149.5 40.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.085 176.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.737 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 70.4 mt -105.21 116.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.866 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 mt -118.78 151.91 37.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.282 0.563 . . . . 0.0 111.71 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -101.68 116.66 45.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.937 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.5 p -84.9 0.12 52.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.982 0.42 . . . . 0.0 111.301 -176.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -95.69 -172.22 2.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.496 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.4 p -106.16 -2.29 22.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -174.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -86.27 124.19 32.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.841 0.353 . . . . 0.0 110.367 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.34 145.65 34.45 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.812 176.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 16.7 Cg_exo -68.29 165.99 26.84 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.707 2.271 . . . . 0.0 112.44 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.4 176.61 37.09 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.19 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -51.62 -47.64 63.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 122.539 0.336 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.2 mt-10 -71.75 -26.24 62.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.532 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -67.1 -34.0 76.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.89 0.376 . . . . 0.0 110.201 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -74.27 -10.1 59.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.034 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -106.5 -5.11 19.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.877 0.37 . . . . 0.0 110.661 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 77.9 mt -74.54 163.78 27.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 48' ' ' GLN . 16.3 m -76.18 149.25 37.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 1.6 mp0 -49.48 -51.17 37.78 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.533 0.521 . . . . 0.0 111.321 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.82 -39.08 94.93 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.623 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' ' HB2' ' A' ' 45' ' ' SER . 83.2 mt-30 -64.75 -41.89 95.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.996 0.427 . . . . 0.0 110.291 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.98 -38.88 86.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.602 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.434 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 80.7 mtp -62.32 -40.86 97.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.189 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -72.66 -25.37 61.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 110.875 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -81.57 -54.46 5.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -92.71 23.88 3.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 0.0 110.528 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' ILE . 86.2 tttt -50.94 -28.8 10.53 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.518 -176.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -66.27 -31.59 72.5 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -143.57 28.86 1.43 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -173.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.463 HD11 ' CG2' ' A' ' 29' ' ' ILE . 15.1 tt -96.56 134.93 32.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.525 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.529 HG22 ' HG2' ' A' ' 90' ' ' PRO . 79.4 t -132.83 127.26 55.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.868 0.366 . . . . 0.0 110.354 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 63.9 mt -95.05 116.95 37.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 176.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 22.6 m -95.6 142.43 13.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.167 0.508 . . . . 0.0 111.68 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.15 114.39 4.2 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.431 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 28' ' ' ALA . 88.3 mt -96.59 9.87 40.22 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 122.61 0.364 . . . . 0.0 110.787 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.7 p -59.9 -31.15 69.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.074 0.464 . . . . 0.0 111.203 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.654 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 2.9 mm-40 -79.19 -19.46 50.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.293 -177.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.3 mt -103.55 113.37 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.584 -175.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -102.15 31.95 3.72 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.758 0.789 . . . . 0.0 110.618 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -145.3 37.72 1.13 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.3 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.474 HG21 ' HB3' ' A' ' 62' ' ' LEU . 40.7 p -69.86 5.01 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.04 -15.58 58.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.631 0.253 . . . . 0.0 111.287 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -89.3 -4.67 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.08 0.466 . . . . 0.0 109.944 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 tp -81.68 116.49 21.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.979 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -99.51 130.4 45.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.727 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.4 ptt85 -90.23 142.47 27.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.8 19.06 45.2 Favored Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 -171.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 6.1 mm-40 -134.67 -167.97 2.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.595 -171.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 88.3 tttt -127.76 138.77 52.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.924 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.523 HG22 HD12 ' A' ' 99' ' ' LEU . 38.3 pt -139.81 168.03 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 121.505 0.669 . . . . 0.0 112.233 -178.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -123.93 106.88 10.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.829 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.0 m -101.6 147.51 8.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -173.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.581 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 6.0 m-90 -110.22 115.4 29.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.815 173.461 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 44.2 p90 -127.94 172.34 10.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 0.0 111.008 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -155.95 -50.02 0.08 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.995 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 m -84.83 119.89 25.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.542 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 84' ' ' ARG . 13.9 ptt180 -139.13 153.03 47.92 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.938 0.399 . . . . 0.0 111.045 -176.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -120.64 106.43 11.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.71 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -86.96 97.94 10.98 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.14 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.8 m -112.27 -14.16 13.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.856 -175.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 60.73 93.59 0.06 OUTLIER Pre-proline 0 N--CA 1.467 0.411 0 O-C-N 123.479 0.487 . . . . 0.0 110.71 -172.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.45 ' HB3' HG23 ' A' ' 57' ' ' ILE . 14.7 Cg_exo -69.87 146.95 83.82 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.797 -1.335 . . . . 0.0 112.299 -1.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.529 ' HG2' HG22 ' A' ' 58' ' ' VAL . 62.0 Cg_endo -74.07 155.95 47.38 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.626 2.217 . . . . 0.0 112.783 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.6 p -128.02 145.05 51.11 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.712 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -129.95 128.54 42.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.681 0.277 . . . . 0.0 111.008 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.3 m -87.29 113.71 23.25 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 29.3 pt -108.29 129.44 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.059 0.457 . . . . 0.0 110.7 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.654 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 82.9 mt-30 -101.33 -9.43 21.18 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.664 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 51.6 tttm -158.72 140.98 14.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.3 165.76 26.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.872 0.367 . . . . 0.0 111.047 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -125.11 117.24 23.48 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.523 HD12 HG22 ' A' ' 77' ' ' ILE . 37.1 tp -70.64 137.99 50.37 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.375 -177.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 90.8 mt . . . . . 0 C--N 1.326 -0.442 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 175.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 61.9 mtm . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.603 0.239 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -85.42 120.08 26.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.14 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.409 ' HG ' ' HE1' ' A' ' 80' ' ' TRP . 7.9 m -96.44 128.45 43.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.502 -174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.441 HD12 ' CE1' ' A' ' 81' ' ' PHE . 11.6 mt -130.21 160.02 35.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.788 173.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -127.57 126.93 68.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.58 166.69 29.19 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.797 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -104.76 132.89 50.46 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.745 0.307 . . . . 0.0 110.285 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.534 HG21 HD11 ' A' ' 71' ' ' LEU . 12.0 t -89.15 100.65 11.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 m -92.12 -40.43 12.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.53 -177.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 99.0 mt -127.78 141.14 51.66 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.916 -178.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -126.39 136.25 52.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.759 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.718 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 7.7 t70 -135.92 -167.15 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -79.49 106.96 11.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 71.41 7.99 6.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.324 0.65 . . . . 0.0 111.841 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.718 ' HG3' ' HB3' ' A' ' 24' ' ' ASP . 32.9 ptt180 -146.46 140.21 26.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.798 0.332 . . . . 0.0 110.398 -176.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.5 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -128.65 142.57 50.99 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.435 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 60.4 mt -97.68 107.07 19.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.436 HD11 HG22 ' A' ' 20' ' ' VAL . 4.0 mm? -102.15 147.28 26.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.959 -176.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.435 ' HA ' ' O ' ' A' ' 56' ' ' ASN . 20.0 mt -106.31 123.71 61.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.076 173.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.5 p -81.71 -7.97 59.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.54 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.21 156.22 38.77 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 175.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.2 p -100.04 12.8 36.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -168.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -125.81 144.11 50.78 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 171.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.9 137.82 79.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 173.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.54 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 56.4 Cg_endo -69.99 177.38 5.79 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.474 2.116 . . . . 0.0 112.318 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.19 169.72 54.09 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.531 -0.843 . . . . 0.0 111.753 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -66.31 -27.01 67.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 37.4 mp0 -62.6 -42.49 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.376 176.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 14.2 m-20 -67.0 -35.27 79.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.433 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -69.6 -23.48 63.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.91 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.29 -15.37 38.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.423 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.7 mt -71.48 173.11 8.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.459 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.8 m -103.04 177.42 4.84 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.49 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.62 -47.54 81.91 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.073 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -33.15 72.39 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.635 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.5 ' HB3' HD13 ' A' ' 44' ' ' LEU . 78.8 mm-40 -65.07 -51.84 59.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.771 0.32 . . . . 0.0 110.63 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.3 mt -67.6 -31.38 71.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.491 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.613 ' HG3' ' HG3' ' A' ' 89' ' ' PRO . 47.9 ttm -63.01 -33.61 75.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.229 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -87.31 -44.62 11.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.224 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -69.82 -54.47 13.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.358 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.445 ' O ' HG22 ' A' ' 57' ' ' ILE . 99.4 m-85 -99.03 46.09 0.99 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tttp -52.15 -35.4 48.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.768 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -111.67 14.45 21.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.823 0.344 . . . . 0.0 111.425 -177.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 31' ' ' ILE . 18.6 m120 -122.88 -4.52 8.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.811 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.445 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.2 tt -97.47 116.36 39.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.531 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.516 HG22 ' HB2' ' A' ' 90' ' ' PRO . 88.4 t -120.88 116.28 49.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.362 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.551 HG12 HG12 ' A' ' 29' ' ' ILE . 59.9 mt -85.32 104.72 13.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 92' ' ' ALA . 34.9 m -93.92 141.29 15.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.167 0.508 . . . . 0.0 111.421 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.37 130.62 9.82 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.589 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 68' ' ' THR . 41.2 mt -105.61 7.74 32.89 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 124.177 0.575 . . . . 0.0 110.189 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.6 m -59.74 -28.56 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -172.175 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -95.07 -14.03 24.63 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.559 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 55.9 mt -107.34 104.28 16.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.73 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -77.53 -23.12 50.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.118 -177.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -85.55 41.04 0.87 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.222 0.534 . . . . 0.0 111.089 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.537 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.8 p -96.07 15.19 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.896 177.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -41.9 93.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.13 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.81 1.73 37.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.17 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.534 HD11 HG21 ' A' ' 20' ' ' VAL . 42.7 tp -77.11 121.18 23.23 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 30.4 mttp -120.69 -172.46 2.38 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.457 -175.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 73' ' ' ARG . 52.2 mtt180 -98.05 134.56 40.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 173.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 88.26 26.39 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 72' ' ' LYS . 9.8 mm-40 -103.5 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.016 0.436 . . . . 0.0 110.51 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -132.14 127.77 36.65 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 176.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.473 HG22 ' HA ' ' A' ' 99' ' ' LEU . 37.4 pt -137.25 155.01 31.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.426 0.631 . . . . 0.0 112.037 -176.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.458 ' HB2' HD11 ' A' ' 100' ' ' LEU . 86.0 tttt -106.95 114.8 29.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.574 173.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 22.6 m -104.56 139.5 25.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 0.0 111.944 -173.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.409 ' HE1' ' HG ' ' A' ' 15' ' ' SER . 4.8 m-90 -109.4 122.82 48.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.118 170.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.441 ' CE1' HD12 ' A' ' 16' ' ' LEU . 2.0 p90 -149.06 177.13 9.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.073 0.463 . . . . 0.0 110.912 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -144.79 -42.01 0.24 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.3 m -82.5 104.76 13.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.163 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -98.76 117.35 33.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -99.2 115.39 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.543 . . . . 0.0 110.523 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.23 90.97 4.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.259 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -98.29 -31.11 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.873 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.83 90.46 0.08 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 124.015 0.822 . . . . 0.0 110.715 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.613 ' HG3' ' HG3' ' A' ' 50' ' ' MET . 36.7 Cg_endo -62.37 151.4 63.99 Favored 'Cis proline' 0 C--N 1.354 0.842 0 C-N-CA 124.762 -0.932 . . . . 0.0 114.16 7.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.516 ' HB2' HG22 ' A' ' 58' ' ' VAL . 51.6 Cg_exo -54.35 144.03 62.81 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.602 2.868 . . . . 0.0 113.911 -174.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.1 t -130.48 164.31 25.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.579 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.414 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.25 170.43 22.28 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.697 0.284 . . . . 0.0 110.484 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -126.66 117.32 22.51 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 27.0 pt -89.46 141.82 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.439 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -95.46 -35.07 11.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.908 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -158.75 149.19 19.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.398 175.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' OH ' ' HA ' ' A' ' 68' ' ' THR . 13.2 p90 -138.93 143.71 38.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.257 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -114.68 129.41 56.68 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.359 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.473 ' HA ' HG22 ' A' ' 77' ' ' ILE . 57.3 tp -76.17 122.47 24.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.621 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 78' ' ' LYS . 87.3 mt . . . . . 0 C--N 1.324 -0.539 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.549 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 65.8 mtm . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -85.43 116.74 23.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 110.17 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.4 m -84.9 125.63 32.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.227 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.461 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 3.0 tm? -116.67 120.2 37.88 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.5 t -98.51 123.71 51.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.143 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.36 169.59 34.37 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.854 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -105.55 140.9 37.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.246 0.218 . . . . 0.0 110.52 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.562 HG21 HD11 ' A' ' 71' ' ' LEU . 22.6 t -87.76 113.92 25.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.64 -41.33 4.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.192 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 95.7 mt -134.02 160.17 38.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.814 0.34 . . . . 0.0 110.416 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -148.43 162.3 39.87 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.826 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -156.68 -164.68 1.7 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -75.81 -47.74 24.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 111.336 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -82.37 -45.89 14.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.861 -176.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.684 ' HG2' ' HA2' ' A' ' 61' ' ' GLY . 33.1 mtm180 -138.71 163.3 32.5 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.569 -169.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -116.12 152.49 33.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.314 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 58.6 mt -109.32 113.99 45.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.075 0.464 . . . . 0.0 110.787 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.53 HD13 HD11 ' A' ' 77' ' ' ILE . 66.9 mt -113.78 144.16 43.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.934 -176.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.3 mt -102.9 120.66 53.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -85.26 -7.58 58.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.095 0.474 . . . . 0.0 111.1 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 10.2 t70 -89.79 158.93 17.28 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.645 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.7 p -97.6 2.6 50.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -81.82 110.37 17.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 173.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.49 131.84 70.56 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.206 -175.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.35 160.39 47.94 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.845 2.363 . . . . 0.0 112.032 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.54 179.58 35.99 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.144 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 7.9 tmtm? -57.94 -41.42 82.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.851 0.358 . . . . 0.0 110.542 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.03 -27.51 64.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.235 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.08 -33.93 76.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.93 0.395 . . . . 0.0 109.967 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.45 -14.23 61.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -89.29 -22.18 22.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.009 0.433 . . . . 0.0 109.956 175.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -69.73 153.07 43.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.665 178.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.9 p -82.93 165.66 19.54 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.151 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 50' ' ' MET . 36.2 mp0 -48.72 -50.98 31.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.709 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.13 -48.99 83.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.748 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -64.02 -32.26 73.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.636 0.255 . . . . 0.0 111.142 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.8 tp -67.34 -41.85 84.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.534 ' HG2' HD13 ' A' ' 57' ' ' ILE . 65.0 mtt -65.7 -32.01 73.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -66.43 -36.03 81.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.867 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -82.81 -54.49 5.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.135 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.32 41.34 1.06 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.343 0.592 . . . . 0.0 110.238 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 77.9 tttt -60.79 124.99 22.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.607 -177.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 4.5 m-20 72.99 4.86 5.08 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.917 0.761 . . . . 0.0 111.256 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.518 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 88.7 m-20 -118.63 11.91 12.96 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.534 HD13 ' HG2' ' A' ' 50' ' ' MET . 13.2 tt -129.06 134.2 64.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.196 -176.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 82.1 t -124.38 132.72 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.459 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 91' ' ' SER . 29.8 mt -98.94 104.9 16.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.645 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.9 m -94.21 128.87 45.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.32 0.581 . . . . 0.0 111.297 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 27' ' ' ARG . . . -80.33 122.06 5.63 Favored Glycine 0 N--CA 1.443 -0.893 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.669 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.42 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.7 mt -88.43 31.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.131 0.491 . . . . 0.0 110.061 -178.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.4 m -63.69 -26.17 68.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.632 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 64' ' ' GLU . 3.6 tp10 -105.26 -3.08 23.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.401 0.619 . . . . 0.0 110.081 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.7 mm -122.62 91.05 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.997 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -98.21 18.09 17.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 122.08 0.943 . . . . 0.0 109.913 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -121.15 14.39 11.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.493 -173.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 32.52 0.26 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -171.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -89.49 -14.66 34.8 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.363 0.601 . . . . 0.0 109.717 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -81.8 -28.52 33.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.451 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.562 HD11 HG21 ' A' ' 20' ' ' VAL . 12.6 tp -57.36 123.29 14.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.806 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -104.73 170.74 7.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 111.165 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.8 mtt85 -87.22 143.3 27.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.24 -0.437 . . . . 0.0 109.979 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.58 42.0 18.74 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -124.28 -174.88 3.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.221 0.534 . . . . 0.0 112.017 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.7 tttm -135.2 125.2 25.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.712 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.63 HD13 HG13 ' A' ' 79' ' ' VAL . 2.6 pp -135.6 171.47 17.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.488 0.661 . . . . 0.0 112.708 -174.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -135.15 111.73 9.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.697 174.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.63 HG13 HD13 ' A' ' 77' ' ' ILE . 27.8 m -107.29 156.02 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.816 0.341 . . . . 0.0 111.208 -176.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 9.8 m-90 -122.69 130.59 53.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.838 175.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 94' ' ' ILE . 44.5 p90 -148.33 -178.34 6.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.034 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -140.99 -45.06 0.39 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.02 175.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.3 m -82.94 117.76 23.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 49.9 ptt85 -139.61 155.04 47.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.758 0.313 . . . . 0.0 110.58 176.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -122.34 128.98 51.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.372 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.52 59.49 4.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.42 0.628 . . . . 0.0 110.139 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -79.12 -22.27 45.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.697 177.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 68.69 102.06 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.811 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.481 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 16.3 Cg_exo -69.0 146.8 81.63 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.829 -1.321 . . . . 0.0 112.194 -0.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 29.9 Cg_exo -61.26 137.56 71.5 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.837 2.358 . . . . 0.0 112.624 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 14.6 m -115.93 145.97 42.47 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.146 176.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -147.41 128.95 15.02 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.588 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 46.7 m -83.41 112.77 20.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.569 ' HA ' ' HB3' ' A' ' 81' ' ' PHE . 40.9 pt -87.04 149.85 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.105 0.479 . . . . 0.0 111.287 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -103.65 -48.09 4.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.32 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -138.48 163.97 30.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.05 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.524 ' HB2' HG12 ' A' ' 79' ' ' VAL . 6.2 p90 -164.23 159.06 19.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.665 0.269 . . . . 0.0 110.725 177.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -121.01 132.75 55.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.711 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 77' ' ' ILE . 38.4 tp -82.1 108.98 16.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.963 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.8 mt . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.406 0.622 . . . . 0.0 109.858 -179.093 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.43 ' SD ' ' HD2' ' A' ' 96' ' ' LYS . 83.2 mtp . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -83.26 121.81 27.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.762 0.315 . . . . 0.0 110.4 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 m -82.74 125.36 31.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.074 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.487 ' O ' HG22 ' A' ' 79' ' ' VAL . 2.7 tm? -138.72 120.59 15.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -89.97 139.16 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -149.61 145.5 13.75 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.18 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.864 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 87.5 m-85 -91.61 121.14 33.01 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.443 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 40.0 t -75.82 93.57 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.48 -38.13 7.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.094 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.793 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 93.2 mt -121.91 124.75 44.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.155 0.503 . . . . 0.0 110.19 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -124.61 119.05 27.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.936 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -118.47 13.61 13.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.121 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 75.08 -55.08 0.65 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.922 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -85.24 -36.77 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 27' ' ' ARG . 43.1 mtp180 -113.39 148.36 35.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.759 176.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.569 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -138.69 130.81 28.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.02 0.438 . . . . 0.0 110.62 175.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 66.8 mt -104.34 115.78 46.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.443 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.4 mt -114.47 147.18 39.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.125 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.89 129.12 53.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 168.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.5 p -53.93 -58.61 6.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.77 0.319 . . . . 0.0 111.005 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.864 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 35.4 t70 -164.71 140.4 5.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.52 0.676 . . . . 0.0 111.952 174.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.3 m -146.97 17.11 1.23 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm 48.25 64.02 1.83 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.975 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.412 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 61.58 96.43 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.994 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 24.7 Cg_endo -62.73 167.73 11.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.774 2.316 . . . . 0.0 111.998 178.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -92.18 167.0 30.01 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.978 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -62.97 -28.97 70.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.224 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 39.4 tt0 -66.06 -33.58 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.547 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.86 -34.03 73.05 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -73.87 -19.24 60.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.868 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -78.69 -30.92 46.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.357 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.8 mt -63.3 142.91 58.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.351 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.2 m -76.0 168.91 19.17 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.404 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.53 -49.55 45.62 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.495 0.497 . . . . 0.0 111.537 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.6 -45.62 95.99 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.22 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.73 -41.49 92.18 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.969 0.414 . . . . 0.0 110.675 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.13 -43.52 98.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.165 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 45.9 ttm -67.21 -34.35 77.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.342 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -71.7 -24.65 61.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.709 0.29 . . . . 0.0 111.245 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.88 -54.84 3.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.951 0.405 . . . . 0.0 110.777 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -97.4 40.17 1.17 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.639 -177.187 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -54.84 -34.99 63.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.417 -173.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -92.37 -5.34 52.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.678 0.275 . . . . 0.0 111.422 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -121.48 3.17 10.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.6 tt -96.28 121.91 47.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.327 0.584 . . . . 0.0 110.834 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.8 t -124.48 121.98 62.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.075 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 91' ' ' SER . 60.3 mt -91.76 105.85 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 34.1 m -98.75 150.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.264 0.554 . . . . 0.0 111.296 -175.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.53 126.58 8.68 Favored Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.841 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.577 ' HB3' HG21 ' A' ' 68' ' ' THR . 85.4 mt -100.72 19.0 17.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.182 0.515 . . . . 0.0 109.853 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.1 m -61.27 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.583 -176.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.65 -51.47 11.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.281 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 49.1 mt -89.28 108.68 19.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.469 -176.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.22 12.13 19.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.824 0.345 . . . . 0.0 111.227 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -112.89 34.52 4.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.304 0.573 . . . . 0.0 109.572 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 62' ' ' LEU . 5.8 p -89.3 2.53 54.21 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -80.22 -11.32 59.75 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.944 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.37 -25.03 63.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.295 172.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.26 158.61 28.51 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.536 174.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -142.86 154.45 44.15 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.722 178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.51 118.07 14.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.155 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 106.2 22.69 7.73 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.136 -0.785 . . . . 0.0 111.136 -175.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -113.48 165.08 12.82 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -127.42 124.39 38.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.922 0.392 . . . . 0.0 110.554 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 99' ' ' LEU . 39.5 pt -130.24 153.14 38.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.782 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE3' ' CZ2' ' A' ' 80' ' ' TRP . 35.9 ttpt -111.8 110.66 21.14 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' A' ' 97' ' ' TYR . 8.6 m -99.6 159.23 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 111.869 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 20.9 m-90 -127.77 128.41 45.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.467 173.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -134.83 175.17 9.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.155 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -95.81 -37.75 10.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.161 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.1 t -154.71 157.19 37.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.535 ' HA ' ' HB2' ' A' ' 92' ' ' ALA . 50.7 ttp180 -121.39 134.92 55.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -88.11 125.26 34.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.951 0.405 . . . . 0.0 110.376 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -80.83 74.52 7.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.209 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -86.68 -24.3 25.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.899 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 33.4 t30 61.09 92.17 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.685 -174.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.44 156.75 96.76 Favored 'Cis proline' 0 C--N 1.345 0.355 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.392 -0.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.11 139.88 92.56 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.863 2.375 . . . . 0.0 112.662 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 18.1 p -135.31 142.75 45.89 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HA ' ' A' ' 84' ' ' ARG . . . -158.28 139.06 12.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.706 0.289 . . . . 0.0 111.19 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -81.17 115.77 20.75 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.4 pt -86.31 135.83 24.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.123 0.487 . . . . 0.0 110.488 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -106.05 -22.89 12.77 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.979 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.43 ' HD2' ' SD ' ' A' ' 13' ' ' MET . 65.2 mttp -142.88 147.34 35.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.915 177.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -152.81 156.77 39.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.987 0.423 . . . . 0.0 110.677 171.906 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -114.84 112.0 22.09 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.565 ' HA ' HG22 ' A' ' 77' ' ' ILE . 6.1 tt -72.31 113.31 9.21 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.9 mt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.201 -172.685 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.505 ' HE1' ' HB2' ' A' ' 95' ' ' GLN . 75.4 mtp . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 85.1 mm-40 -83.76 115.19 22.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.089 0.471 . . . . 0.0 109.865 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.6 t -96.93 129.9 44.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.222 -172.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.9 137.37 29.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.7 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 62.1 t -97.68 137.76 24.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 32' ' ' THR . . . -148.62 154.5 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.432 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.7 127.14 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.436 ' HA ' HD22 ' A' ' 30' ' ' LEU . 10.9 t -83.02 102.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 p -120.51 -49.41 3.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.608 ' HB3' ' HB ' ' A' ' 29' ' ' ILE . 25.8 tp -122.7 138.76 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.773 0.32 . . . . 0.0 110.855 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -131.06 162.87 28.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.869 0.366 . . . . 0.0 110.781 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -123.05 -69.87 0.8 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.351 171.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -166.09 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.936 176.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -93.8 -15.43 25.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.243 0.544 . . . . 0.0 110.268 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 27' ' ' ARG . 14.6 ptt180 -116.49 141.37 48.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.811 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.41 145.94 47.4 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.425 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' A' ' 22' ' ' LEU . 66.6 mt -107.33 108.17 24.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.963 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 20' ' ' VAL . 58.8 mt -116.06 149.8 38.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.981 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.467 HD12 ' HG3' ' A' ' 37' ' ' PRO . 54.6 mt -109.26 122.05 63.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.402 ' HA ' ' HA2' ' A' ' 18' ' ' GLY . 23.9 p -94.3 7.56 44.96 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 34' ' ' THR . 31.9 t70 -163.58 -162.73 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.581 ' HG1' ' HE1' ' A' ' 53' ' ' PHE . 6.5 m 82.15 23.07 0.23 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.686 0.795 . . . . 0.0 111.854 175.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.0 tttm 56.8 42.52 26.5 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.414 169.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.63 134.36 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.543 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.467 ' HG3' HD12 ' A' ' 31' ' ' ILE . 45.1 Cg_exo -56.25 136.58 76.07 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.826 2.351 . . . . 0.0 112.107 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.63 -163.34 30.3 Favored Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.713 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -52.64 -58.29 7.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.859 0.464 . . . . 0.0 111.89 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -68.34 -27.29 66.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.754 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -67.76 -30.55 70.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.83 0.348 . . . . 0.0 110.648 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -83.49 -1.77 54.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.845 0.355 . . . . 0.0 111.06 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -110.6 -10.97 14.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 93.1 mt -79.6 149.15 31.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.031 0.443 . . . . 0.0 111.248 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.7 m -88.77 -178.93 5.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.242 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -55.2 -60.84 2.83 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.03 -33.97 86.1 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.569 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -71.49 -37.26 71.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.362 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.97 -42.77 94.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.566 176.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 80.4 mtp -66.77 -23.64 66.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.922 177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -74.95 -42.24 58.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.856 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -77.17 -45.71 25.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 110.668 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.581 ' HE1' ' HG1' ' A' ' 34' ' ' THR . 89.2 m-85 -98.81 44.65 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -175.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -44.09 -39.2 4.07 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -121.29 9.81 10.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -176.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -120.22 -5.45 9.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.8 tt -99.37 132.06 45.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.928 0.394 . . . . 0.0 109.955 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 63.5 t -122.97 126.97 74.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.945 0.403 . . . . 0.0 110.617 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.6 mt -96.72 100.91 11.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.6 m -89.1 141.99 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.124 0.488 . . . . 0.0 111.374 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.77 115.33 4.63 Favored Glycine 0 N--CA 1.441 -0.996 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.18 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.4 mt -94.47 27.09 3.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 0.0 110.123 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.5 m -55.57 -35.84 66.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.89 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 14.8 mm-40 -81.87 -6.91 59.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 111.092 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -114.32 99.91 9.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -68.45 -41.06 80.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.414 -174.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -107.01 106.75 17.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.929 0.395 . . . . 0.0 110.737 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -98.3 18.58 16.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.425 0.631 . . . . 0.0 109.517 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.39 -29.83 70.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.304 -171.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -81.28 -17.81 48.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt -71.5 125.06 26.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.908 0.385 . . . . 0.0 110.568 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -106.68 -172.59 2.11 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.878 -176.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 73' ' ' ARG . 15.8 ttt180 -111.36 126.01 54.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 177.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 33.65 5.36 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.781 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.09 179.58 3.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 111.103 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -129.44 129.6 44.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.397 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 99' ' ' LEU . 30.1 pt -130.84 145.13 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.019 0.438 . . . . 0.0 111.275 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.564 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 8.1 ttpm? -106.34 107.27 18.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.2 m -98.24 154.25 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.019 0.438 . . . . 0.0 111.711 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.564 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 23.2 m-90 -121.34 115.45 22.97 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.132 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.538 ' HB3' HG22 ' A' ' 94' ' ' ILE . 5.5 p90 -118.01 166.83 12.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.556 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -126.97 -25.61 3.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.357 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.8 m -117.86 111.61 19.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.937 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.7 mtm180 -108.45 140.1 42.25 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.035 172.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -121.59 110.23 15.74 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -79.25 87.6 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.985 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.4 p -102.15 -26.78 13.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.207 177.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.5 m120 57.98 90.96 0.08 OUTLIER Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.348 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.425 ' HB3' HG23 ' A' ' 57' ' ' ILE . 46.3 Cg_endo -67.82 136.04 32.19 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.81 1.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.75 153.31 29.69 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.61 2.207 . . . . 0.0 113.039 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -116.01 153.64 31.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.336 176.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -148.08 132.82 17.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.743 0.306 . . . . 0.0 110.758 -179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.9 m -90.71 116.22 28.41 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.936 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.538 HG22 ' HB3' ' A' ' 81' ' ' PHE . 46.8 pt -101.66 148.59 7.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.946 0.403 . . . . 0.0 110.725 -178.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.505 ' HB2' ' HE1' ' A' ' 13' ' ' MET . 97.0 mt-30 -111.44 -28.2 8.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.36 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -136.94 152.83 50.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.725 -179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -154.56 144.95 22.1 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -114.55 118.26 33.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.047 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.57 ' HA ' HG22 ' A' ' 77' ' ' ILE . 3.0 tt -77.62 111.11 13.04 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 76.4 mt . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.426 -175.505 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.0 mtm . . . . . 0 CA--C 1.519 -0.229 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -83.78 125.45 31.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.981 0.42 . . . . 0.0 110.474 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.0 m -85.24 124.72 32.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.539 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.488 HD11 ' HA ' ' A' ' 32' ' ' THR . 2.9 tm? -121.98 112.85 18.79 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.1 t -93.36 115.23 31.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 -172.07 18.12 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.752 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.35 136.06 54.82 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.923 0.392 . . . . 0.0 110.918 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.438 HG21 HD21 ' A' ' 71' ' ' LEU . 13.0 t -85.59 93.82 3.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.497 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 m -82.64 -34.98 12.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.842 -178.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.7 mt -133.52 127.58 33.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.107 0.479 . . . . 0.0 110.613 178.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -111.92 126.27 54.93 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.271 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 37.0 t70 -128.21 166.4 18.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 81.1 m-20 -67.77 106.56 2.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.835 0.35 . . . . 0.0 110.141 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 47.7 mt-10 78.82 5.81 2.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.645 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.797 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 9.3 mpt_? -127.83 119.61 26.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.914 0.388 . . . . 0.0 110.955 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.536 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -110.27 107.98 17.93 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.695 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 62.8 mt -85.73 104.35 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.49 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.435 ' CD2' HG22 ' A' ' 20' ' ' VAL . 36.5 mt -111.54 151.74 28.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.529 -171.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.472 HG22 ' H ' ' A' ' 33' ' ' ASP . 58.6 mt -97.45 123.71 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 168.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.488 ' HA ' HD11 ' A' ' 16' ' ' LEU . 12.2 p -78.6 -10.59 59.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.018 0.437 . . . . 0.0 111.396 -177.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.494 ' OD1' ' HG3' ' A' ' 35' ' ' LYS . 6.1 t70 -89.64 162.05 15.81 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.9 p -100.96 9.59 42.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.494 ' HG3' ' OD1' ' A' ' 33' ' ' ASP . 68.0 mttm -77.25 131.7 38.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.238 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.5 122.79 73.39 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.504 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 165.89 30.94 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.797 2.332 . . . . 0.0 112.168 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.72 -172.59 27.96 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.776 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.77 -41.27 99.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.027 0.441 . . . . 0.0 110.488 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 34.4 tt0 -64.71 -37.12 86.52 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.39 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.457 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.0 m-20 -60.53 -45.03 95.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -70.88 -14.35 62.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.527 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -93.91 -15.44 24.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.752 0.31 . . . . 0.0 110.749 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.3 mt -72.53 154.19 40.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.2 176.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.1 p -84.98 170.14 13.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -176.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -50.24 -48.75 54.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.236 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.3 -43.18 99.45 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.616 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -70.92 -35.96 72.46 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.77 -0.253 . . . . 0.0 111.348 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 41' ' ' ASP . 67.3 mt -68.91 -36.92 78.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.89 0.376 . . . . 0.0 110.471 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.494 ' HA ' HG21 ' A' ' 57' ' ' ILE . 42.6 ttm -61.78 -34.58 76.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.504 176.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -82.71 -44.35 15.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.319 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.09 -34.32 74.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -114.41 43.1 1.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.121 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -50.63 119.53 3.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.107 -176.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 69.15 0.19 2.73 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.75 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -96.15 -20.42 18.62 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 170.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.494 HG21 ' HA ' ' A' ' 50' ' ' MET . 8.4 tt -90.24 123.32 42.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.358 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -125.51 125.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.251 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.656 HG12 HG12 ' A' ' 29' ' ' ILE . 58.0 mt -94.57 108.86 21.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 ' HB3' ' A' ' 92' ' ' ALA . 24.8 m -98.25 143.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.471 . . . . 0.0 110.88 -179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.44 134.0 12.7 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.102 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.546 HD22 HG21 ' A' ' 68' ' ' THR . 69.4 mt -105.42 16.33 25.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.827 0.346 . . . . 0.0 110.245 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.2 m -60.54 -33.07 72.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.303 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.41 -33.87 61.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.684 0.278 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.7 mt -108.33 97.73 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.304 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.51 6.78 22.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.28 0.562 . . . . 0.0 110.88 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -99.12 14.51 29.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.21 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.546 HG21 HD22 ' A' ' 62' ' ' LEU . 6.9 p -86.4 7.64 24.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.62 -12.46 59.5 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.281 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.77 -19.99 61.93 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.981 174.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.438 HD21 HG21 ' A' ' 20' ' ' VAL . 25.3 tp -67.54 147.35 52.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.61 178.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -119.47 172.4 7.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.185 0.516 . . . . 0.0 111.73 -178.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -84.9 126.25 33.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.489 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.11 26.31 19.3 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -175.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -95.64 160.04 14.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 111.142 -173.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HG2' HD12 ' A' ' 100' ' ' LEU . 46.4 tttp -117.92 111.31 18.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -177.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.49 HG22 HD12 ' A' ' 99' ' ' LEU . 44.5 pt -132.4 171.84 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.745 0.783 . . . . 0.0 112.943 -173.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -133.45 111.65 10.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.882 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.493 ' HB ' HG21 ' A' ' 94' ' ' ILE . 34.9 m -106.62 157.43 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -117.39 123.06 45.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.098 172.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -126.22 157.71 37.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.813 0.34 . . . . 0.0 110.554 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -87.4 -36.88 17.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.093 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.8 t -150.11 168.61 23.42 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.238 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -123.77 132.0 53.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -110.21 95.24 5.46 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -82.81 84.6 7.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.198 0.523 . . . . 0.0 110.996 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 m -84.78 -12.47 53.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.115 175.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 60.31 89.99 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.546 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.482 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 58.3 Cg_endo -70.13 151.24 92.23 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.877 -1.301 . . . . 0.0 113.132 2.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 11.0 Cg_exo -71.14 153.11 62.58 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.096 2.53 . . . . 0.0 113.107 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 t -135.4 160.91 36.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.654 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.542 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.14 170.66 21.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 23.9 m -131.74 130.9 42.51 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.493 HG21 ' HB ' ' A' ' 79' ' ' VAL . 44.5 pt -109.09 145.05 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.966 0.412 . . . . 0.0 111.158 -176.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -109.13 -16.24 14.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -161.71 147.72 13.78 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -152.19 164.9 36.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -114.8 136.45 53.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.867 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.49 HD12 HG22 ' A' ' 77' ' ' ILE . 29.8 tp -92.26 118.88 31.32 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.544 HD12 ' HG2' ' A' ' 76' ' ' LYS . 93.7 mt . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.196 0.522 . . . . 0.0 110.582 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.408 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 67.4 mtm . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.39 116.55 22.54 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.511 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 12.3 t -103.9 144.57 31.33 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.199 0.523 . . . . 0.0 111.694 -171.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.0 OUTLIER -135.52 136.99 41.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.493 ' N ' HD13 ' A' ' 16' ' ' LEU . 58.7 t -106.19 124.11 61.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.7 0.286 . . . . 0.0 110.393 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.25 167.72 29.0 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.11 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -104.94 128.01 53.02 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.502 HG21 HD11 ' A' ' 71' ' ' LEU . 21.9 t -75.69 99.2 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.454 HG12 ' CE2' ' A' ' 42' ' ' TYR . 34.6 m -98.27 -38.73 7.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.671 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 94.4 mt -131.46 131.5 43.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.667 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -116.07 119.77 36.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.548 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -88.42 -73.69 0.49 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.396 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.5 t30 171.73 -64.13 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.66 -25.72 21.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.141 175.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.9 OUTLIER -116.55 151.89 35.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.694 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.546 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.35 127.84 41.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.65 173.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.731 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 68.0 mt -89.68 107.93 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.2 mt -111.24 137.72 48.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.486 -177.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.448 HD11 HD13 ' A' ' 49' ' ' LEU . 9.7 mt -105.27 148.76 9.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.484 HG21 HD11 ' A' ' 16' ' ' LEU . 19.1 p -128.76 155.18 45.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.268 -176.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 54.28 41.26 32.08 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.631 0.582 . . . . 0.0 111.122 176.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -108.77 -4.59 16.81 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.011 -175.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.37 36.06 23.26 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.956 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 64.34 107.45 0.03 OUTLIER Pre-proline 0 N--CA 1.464 0.253 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.87 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 26.4 Cg_endo -63.14 163.67 22.14 Favored 'Trans proline' 0 C--O 1.237 0.443 0 C-N-CA 122.802 2.334 . . . . 0.0 112.293 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.459 ' O ' ' HD1' ' A' ' 42' ' ' TYR . . . -89.82 172.22 38.54 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.887 -178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.18 -25.54 68.12 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.659 0.266 . . . . 0.0 111.128 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.88 -29.96 56.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.071 0.462 . . . . 0.0 110.175 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -69.95 -35.7 74.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.459 ' HD1' ' O ' ' A' ' 38' ' ' GLY . 69.3 m-85 -71.12 -16.21 62.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.458 174.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -83.41 -28.94 28.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.045 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -67.9 142.55 56.03 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.306 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 m -91.32 -174.14 3.84 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.474 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -52.55 -56.22 16.75 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.026 -173.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.91 92.74 Favored Glycine 0 N--CA 1.454 -0.144 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.388 -177.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.63 -39.33 80.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.578 0.228 . . . . 0.0 111.148 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD13 HD11 ' A' ' 31' ' ' ILE . 90.7 mt -78.26 -35.67 47.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.964 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 42.9 ttm -58.83 -42.73 89.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -93.24 2.76 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.463 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -100.56 -40.48 7.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.196 0.522 . . . . 0.0 109.76 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 56' ' ' ASN . 81.0 m-85 -118.58 55.58 0.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.59 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -51.5 -35.95 42.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.5 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -100.42 -8.77 22.88 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.593 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 53' ' ' PHE . 2.9 m-20 -114.02 2.03 14.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -171.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 12.6 tt -98.48 123.74 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.113 0.482 . . . . 0.0 110.861 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -125.02 126.02 70.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.967 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 91' ' ' SER . 61.6 mt -97.84 105.18 16.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.9 m -90.68 150.44 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.277 -176.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.66 119.59 6.53 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.883 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 28' ' ' ALA . 35.4 mt -92.33 7.99 40.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.09 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.0 t -65.46 -23.69 66.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.296 -170.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -97.72 5.52 49.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.088 0.47 . . . . 0.0 111.214 -175.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 52.3 mt -95.75 154.96 3.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.253 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -68.93 0.13 Allowed 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.363 0.414 . . . . 0.0 110.928 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -163.41 131.04 3.55 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.507 HG21 HD13 ' A' ' 62' ' ' LEU . 37.0 p -97.29 35.3 1.63 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.039 -174.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -68.28 -22.56 64.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.091 -177.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -92.95 5.93 49.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.112 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.502 HD11 HG21 ' A' ' 20' ' ' VAL . 24.1 tp -99.02 121.19 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.365 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -114.1 -172.57 2.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.954 0.407 . . . . 0.0 110.544 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -85.47 146.1 27.11 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.479 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 76.46 39.93 29.19 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.636 174.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -127.02 158.62 36.45 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.619 -177.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 38.5 mttp -102.62 136.45 42.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.4 pt -133.1 140.44 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.336 0.589 . . . . 0.0 111.25 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 88.0 tttt -100.29 106.82 18.5 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 173.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 15' ' ' SER . 29.2 m -100.16 154.11 4.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.582 -172.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.507 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 18.6 m-90 -120.61 117.65 28.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.414 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.615 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -133.88 167.15 21.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.825 -175.354 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -152.37 -37.7 0.11 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.739 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 7.1 m -80.23 108.02 13.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.451 176.647 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -102.52 153.51 20.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.148 0.499 . . . . 0.0 111.532 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 98.0 mttt -133.6 114.01 13.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.747 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.9 58.31 3.35 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.852 0.834 . . . . 0.0 109.697 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.6 t -76.37 -16.4 59.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.171 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 p30 42.92 100.08 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 112.382 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.15 150.07 75.3 Favored 'Cis proline' 0 C--N 1.345 0.381 0 C-N-CA 123.804 -1.332 . . . . 0.0 113.053 3.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.47 136.54 74.96 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.014 2.476 . . . . 0.0 112.524 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.645 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 19.7 m -115.72 149.03 39.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.567 177.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 81' ' ' PHE . . . -143.53 121.63 12.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.794 0.33 . . . . 0.0 111.258 -177.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 29.3 m -82.07 113.67 20.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.615 HG22 ' HB3' ' A' ' 81' ' ' PHE . 35.2 pt -96.18 142.58 13.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.033 0.444 . . . . 0.0 110.697 -177.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -90.59 -19.28 23.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.092 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -171.01 150.26 3.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.655 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.77 157.94 31.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.507 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 23.2 tt0 -115.54 112.34 22.06 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.5 tp -71.58 107.18 4.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.739 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.416 ' HB2' ' HB2' ' A' ' 76' ' ' LYS . 78.5 mt . . . . . 0 C--N 1.322 -0.602 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.477 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.574 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 95.8 mmm . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 83.9 mm-40 -83.38 118.62 23.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 111.195 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 m -81.15 111.9 18.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.544 HD11 HG22 ' A' ' 32' ' ' THR . 2.0 tm? -130.92 124.89 32.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.75 132.3 37.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.786 0.327 . . . . 0.0 110.327 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.59 162.78 28.93 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.755 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -105.84 126.03 51.7 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.576 0.227 . . . . 0.0 110.648 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.44 107.62 4.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.467 HG13 ' HG ' ' A' ' 22' ' ' LEU . 12.2 p -120.23 -32.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 123.271 0.357 . . . . 0.0 111.062 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.992 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.9 mt -127.73 145.07 51.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.818 0.342 . . . . 0.0 110.999 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -119.1 135.8 54.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.35 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 0.9 OUTLIER -92.77 -66.77 0.9 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.141 171.128 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 6.1 t30 160.9 -51.45 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.18 -24.76 14.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.406 -1.27 . . . . 0.0 108.69 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 24.3 mtm180 -117.92 158.95 23.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.607 -1.178 . . . . 0.0 110.464 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -124.61 139.87 53.47 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 175.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 32.5 mt -102.41 109.29 26.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 mt -113.16 144.39 42.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.047 -172.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.76 119.74 35.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.883 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 HD11 ' A' ' 16' ' ' LEU . 75.9 p -81.78 -23.66 36.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.959 0.409 . . . . 0.0 110.665 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.401 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 38.7 t70 -78.48 95.08 5.05 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 174.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 t -63.88 90.69 0.06 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.155 0.978 . . . . 0.0 112.127 -173.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -138.35 135.56 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.656 -1.157 . . . . 0.0 108.356 172.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.35 113.24 15.41 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.498 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.0 158.02 50.27 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.62 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.37 168.99 48.92 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.938 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -64.1 -28.12 69.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.948 0.404 . . . . 0.0 110.593 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -81.38 -26.56 35.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.911 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.67 -34.73 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -69.33 -16.19 63.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.665 175.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -94.53 -18.06 21.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.772 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.92 152.87 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.117 0.484 . . . . 0.0 110.953 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.3 p -77.51 166.62 22.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.322 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HA ' ' CD1' ' A' ' 22' ' ' LEU . 37.2 tt0 -52.77 -52.69 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.936 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.68 -42.13 99.71 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.686 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -68.04 -37.38 81.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.754 0.277 . . . . 0.0 111.654 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.525 HD12 HD21 ' A' ' 22' ' ' LEU . 72.8 mt -70.42 -34.17 72.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.796 0.331 . . . . 0.0 110.501 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.415 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 62.7 mtt -73.22 -15.7 61.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.094 176.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -91.04 -40.16 11.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.861 0.363 . . . . 0.0 110.35 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.31 -47.71 69.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.449 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.65 46.86 0.94 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.81 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 50' ' ' MET . 57.0 tttp -56.27 131.14 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -176.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 69.19 -5.52 1.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.276 -0.874 . . . . 0.0 112.206 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 29.0 m-80 -106.14 9.75 32.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.579 0.704 . . . . 0.0 109.495 176.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 29' ' ' ILE . 20.2 tt -120.48 128.62 76.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.603 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HG2' ' A' ' 90' ' ' PRO . 53.7 t -121.98 137.84 54.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.893 0.378 . . . . 0.0 110.969 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 91' ' ' SER . 56.5 mt -95.93 111.13 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.97 139.03 18.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.155 0.502 . . . . 0.0 111.231 -177.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -87.57 113.09 3.93 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.573 HD11 ' HB2' ' A' ' 28' ' ' ALA . 59.5 mt -87.55 43.13 1.09 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.026 0.441 . . . . 0.0 110.39 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.4 t -59.52 -45.51 91.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.654 -176.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 1.1 mp0 -87.86 11.09 16.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.05 0.453 . . . . 0.0 111.27 -176.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 62' ' ' LEU . 51.4 mm -106.45 134.38 48.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.44 -64.27 1.21 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.163 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -123.69 140.64 52.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.7 p -111.45 27.58 9.54 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.163 0.506 . . . . 0.0 111.551 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -73.01 -25.13 60.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.189 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -74.59 -27.22 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.692 0.282 . . . . 0.0 111.118 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.06 125.13 25.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -114.74 150.98 34.49 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 48.2 mtm105 -68.83 112.46 5.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 171.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.0 33.38 4.67 Favored Glycine 0 N--CA 1.443 -0.897 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 -174.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -118.53 151.38 37.96 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.498 ' HG2' HD12 ' A' ' 100' ' ' LEU . 81.1 tttt -111.8 122.99 49.3 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.827 0.346 . . . . 0.0 110.755 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.489 HG22 HD12 ' A' ' 99' ' ' LEU . 38.2 pt -132.14 149.6 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.296 0.57 . . . . 0.0 111.347 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -105.96 108.13 19.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 97' ' ' TYR . 28.2 m -98.66 153.02 4.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.255 0.55 . . . . 0.0 111.632 -173.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.574 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 8.5 m-90 -121.2 113.46 20.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.802 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 94' ' ' ILE . 30.4 p90 -107.24 146.93 30.84 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.619 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -99.22 -25.17 14.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.326 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -160.29 152.59 20.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 92' ' ' ALA . 32.9 mtm180 -110.25 169.75 8.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.344 0.592 . . . . 0.0 111.064 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 91' ' ' SER . 57.5 tttp -140.74 91.39 2.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.015 -0.993 . . . . 0.0 108.47 173.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 35.2 tt0 -83.96 109.81 17.92 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.363 -173.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -121.08 -0.27 10.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.417 174.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 59.37 102.08 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.47 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.212 -175.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.42 146.07 72.14 Favored 'Cis proline' 0 C--N 1.344 0.301 0 C-N-CA 123.563 -1.432 . . . . 0.0 112.24 0.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.532 ' HG2' HG22 ' A' ' 58' ' ' VAL . 20.6 Cg_endo -62.82 138.78 70.82 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.489 2.126 . . . . 0.0 112.202 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 28.2 t -104.0 156.09 18.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 84' ' ' ARG . . . -147.56 108.58 4.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.685 0.278 . . . . 0.0 110.911 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.4 m -73.02 110.08 7.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.859 0.361 . . . . 0.0 110.601 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 81' ' ' PHE . 45.4 pt -98.95 147.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.356 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.686 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 96.7 mt-30 -109.61 -8.98 14.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.581 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -165.98 148.74 7.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.172 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.512 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -137.35 167.37 21.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 172.475 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -129.32 131.06 46.84 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.489 HD12 HG22 ' A' ' 77' ' ' ILE . 17.4 tp -79.17 111.87 15.83 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -178.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.498 HD12 ' HG2' ' A' ' 76' ' ' LYS . 86.0 mt . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.983 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.434 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 72.8 mtp . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.768 0.318 . . . . 0.0 110.333 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.4 mt-30 -88.67 135.3 33.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.848 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 35.8 p -101.67 139.43 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.634 -174.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.3 tp -140.34 120.82 14.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.542 177.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.434 HG22 ' HB2' ' A' ' 78' ' ' LYS . 55.9 t -90.23 127.01 43.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.293 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.64 158.6 27.73 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.148 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.791 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 80.0 m-85 -99.37 129.77 45.6 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.8 t -83.07 108.4 15.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.227 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.2 m -103.34 -28.48 3.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 123.318 0.386 . . . . 0.0 111.033 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 29' ' ' ILE . 39.2 tp -136.21 122.82 20.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.869 0.366 . . . . 0.0 110.55 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -105.96 123.57 48.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.659 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -113.04 167.57 10.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.84 -31.96 68.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.63 0.252 . . . . 0.0 111.517 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -122.76 1.86 9.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.593 0.235 . . . . 0.0 111.324 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -142.83 167.78 21.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.82 0.343 . . . . 0.0 110.665 -174.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.496 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.72 119.66 9.35 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.8 173.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.923 HD12 HD23 ' A' ' 22' ' ' LEU . 33.3 mt -85.73 107.86 16.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-O 121.217 0.532 . . . . 0.0 110.014 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.458 HD22 HG22 ' A' ' 20' ' ' VAL . 20.2 mt -110.44 141.94 42.85 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.163 -176.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.4 mt -101.92 122.13 53.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -71.47 91.77 1.06 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.083 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.791 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 45.9 t0 65.22 93.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.848 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.44 10.66 40.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.233 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 56.13 35.66 26.06 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -172.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.43 102.98 0.03 OUTLIER Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.61 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.4 157.21 32.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.869 2.38 . . . . 0.0 112.391 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.11 166.85 39.11 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.641 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -57.67 -37.38 73.29 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.744 0.307 . . . . 0.0 111.06 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 19.2 mm-40 -73.84 -24.01 59.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.64 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.6 -33.87 71.53 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.52 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 80.5 m-85 -74.82 -17.92 60.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.363 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -90.12 -12.62 37.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.062 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 85.5 mt -67.42 166.14 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.129 0.49 . . . . 0.0 111.079 176.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.1 p -97.65 171.78 8.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.82 -55.8 23.35 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.303 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -57.9 -41.19 94.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.264 -0.493 . . . . 0.0 112.842 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -63.42 -44.38 94.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.738 0.304 . . . . 0.0 110.692 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.68 -42.74 98.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.405 ' HG2' HD13 ' A' ' 57' ' ' ILE . 88.9 mtp -60.22 -33.88 72.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.652 -179.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -92.22 -34.89 14.1 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -71.33 -47.78 54.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.9 0.381 . . . . 0.0 110.425 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -106.04 44.08 1.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.633 0.73 . . . . 0.0 109.86 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 81.3 tttt -54.62 140.6 34.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.246 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 92.7 m-20 76.37 -40.96 0.4 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.62 0.768 . . . . 0.0 112.329 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -80.83 -1.04 41.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 0.0 110.806 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.517 HG23 ' HB3' ' A' ' 89' ' ' PRO . 7.4 tt -90.8 118.77 36.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.308 0.575 . . . . 0.0 110.43 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -117.92 125.19 74.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.108 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.679 HG12 HG12 ' A' ' 29' ' ' ILE . 55.1 mt -99.49 100.35 10.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 35.5 m -83.66 154.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.412 ' CA ' ' HA ' ' A' ' 93' ' ' THR . . . -96.41 125.95 8.63 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.934 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.57 ' HB3' HG21 ' A' ' 68' ' ' THR . 86.6 mt -109.31 9.74 25.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 -178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -64.78 -21.99 66.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.451 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -91.88 0.66 57.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.709 0.29 . . . . 0.0 111.156 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.34 117.8 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.868 0.365 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.76 -55.88 6.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.047 0.451 . . . . 0.0 111.658 -176.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -85.35 66.85 9.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.208 0.528 . . . . 0.0 111.736 -173.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 62' ' ' LEU . 69.1 p -99.54 8.9 44.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.229 172.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.79 -18.92 65.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.731 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -77.51 -12.43 59.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.302 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 15.5 tp -87.92 126.25 34.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.792 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.407 ' HD2' ' OE2' ' A' ' 75' ' ' GLU . 35.8 mttt -112.76 -179.82 3.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.133 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -88.57 59.56 5.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.85 0.357 . . . . 0.0 110.417 174.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.52 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 176.54 42.61 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HG3' HD12 ' A' ' 71' ' ' LEU . 40.5 mm-40 -111.87 173.18 6.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.288 0.566 . . . . 0.0 111.441 -173.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -137.48 102.23 4.72 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.641 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.1 pt -125.44 154.9 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.764 0.793 . . . . 0.0 113.093 -170.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.495 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 43.3 tttt -115.77 106.44 13.86 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.301 -1.318 . . . . 0.0 108.551 175.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 15' ' ' SER . 22.1 m -96.14 156.86 3.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -169.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.495 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 5.4 m-90 -122.99 126.44 47.16 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.338 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -136.86 160.16 39.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.584 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -96.45 -23.08 16.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -157.57 158.51 35.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.124 -174.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -122.98 154.16 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.18 0.514 . . . . 0.0 110.805 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -103.68 102.51 12.37 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -77.85 62.24 2.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.911 -175.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.7 p -81.66 -30.15 32.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.031 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 66.3 101.72 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.42 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.669 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.517 ' HB3' HG23 ' A' ' 57' ' ' ILE . 31.3 Cg_endo -63.11 142.13 42.3 Favored 'Cis proline' 0 C--N 1.347 0.484 0 C-N-CA 123.779 -1.342 . . . . 0.0 112.657 2.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 34.3 Cg_exo -58.91 134.91 63.26 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.79 2.327 . . . . 0.0 112.159 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.3 p -123.45 144.59 49.41 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.85 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -151.26 110.3 3.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.285 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.412 ' HA ' ' CA ' ' A' ' 61' ' ' GLY . 12.8 m -68.29 117.25 9.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.216 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG21 ' HB ' ' A' ' 79' ' ' VAL . 42.5 pt -100.6 151.77 5.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.154 0.502 . . . . 0.0 110.938 -176.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -112.78 -18.65 12.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.338 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -143.1 151.13 40.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.777 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 94' ' ' ILE . 1.2 p90 -155.93 150.01 25.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.965 0.412 . . . . 0.0 110.02 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.44 124.47 52.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.413 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.63 117.67 23.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.952 0.406 . . . . 0.0 110.393 -177.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.084 179.813 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 70.3 mtm . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 120.848 0.356 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -83.66 121.11 26.82 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.263 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.517 ' HB3' ' HE2' ' A' ' 78' ' ' LYS . 48.8 m -85.42 129.24 34.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.123 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 16' ' ' LEU . 1.1 tm? -137.5 124.56 21.54 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.8 t -90.31 126.67 43.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.99 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.44 169.31 29.05 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.359 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.415 ' CD2' ' HG2' ' A' ' 76' ' ' LYS . 94.2 m-85 -107.14 133.96 50.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.657 0.265 . . . . 0.0 110.353 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 20.0 t -85.39 110.27 19.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.34 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.8 t -107.23 -63.19 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 123.497 0.498 . . . . 0.0 110.704 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 1.018 HD23 HD12 ' A' ' 29' ' ' ILE . 41.6 tp -111.51 110.47 20.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.948 0.404 . . . . 0.0 110.702 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HE3' ' HA ' ' A' ' 69' ' ' ASP . 42.6 tttm -100.01 126.58 46.22 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 15.7 t70 -106.27 -158.08 0.64 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 174.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.452 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 72.9 m-20 -89.1 -54.72 3.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.172 0.511 . . . . 0.0 109.747 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -98.26 -10.72 23.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.027 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.2 mtt180 -131.87 149.7 52.37 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.733 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -127.13 115.36 19.0 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 172.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 1.018 HD12 HD23 ' A' ' 22' ' ' LEU . 34.7 mt -87.94 107.55 17.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.394 0.616 . . . . 0.0 110.396 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.3 mt -114.32 158.13 21.86 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.416 -176.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.55 ' CG2' ' HB ' ' A' ' 34' ' ' THR . 36.9 mt -110.37 123.8 66.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.3 p -78.14 107.85 11.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.375 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 54.05 75.49 0.27 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.634 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.55 ' HB ' ' CG2' ' A' ' 31' ' ' ILE . 10.0 t -108.56 -0.01 20.56 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.637 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.8 mttp 57.11 41.18 27.67 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.837 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.98 112.57 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.8 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.536 ' HG3' HG21 ' A' ' 34' ' ' THR . 6.5 Cg_exo -73.03 178.88 5.95 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.833 2.356 . . . . 0.0 111.469 176.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.5 166.23 25.27 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.31 -178.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -62.79 -27.21 69.15 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.6 mt-10 -59.71 -47.6 85.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.363 174.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -67.04 -32.87 74.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.833 -175.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.503 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 53.6 m-85 -73.45 -16.44 61.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 111.058 177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -93.44 -22.14 19.08 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.07 0.462 . . . . 0.0 110.143 178.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 89.7 mt -69.52 157.1 37.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.056 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -88.1 179.07 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.363 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -58.9 -43.58 91.06 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.346 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.8 -42.27 93.13 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.478 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mt-30 -64.16 -39.53 94.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.065 0.46 . . . . 0.0 110.429 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.2 tp -68.96 -48.38 63.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.34 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.439 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 41.3 ttm -55.88 -49.02 74.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.918 -174.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -81.98 -8.43 59.67 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -90.11 -51.5 5.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.003 0.43 . . . . 0.0 110.408 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -101.75 33.24 3.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -56.89 -29.52 63.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -170.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -101.44 3.43 40.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.452 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -132.84 18.16 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.124 0.487 . . . . 0.0 110.063 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.449 HD11 ' CG2' ' A' ' 29' ' ' ILE . 17.5 tt -109.75 134.08 52.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.744 -174.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.4 t -132.64 122.59 47.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.042 0.448 . . . . 0.0 110.448 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.715 HG12 HG12 ' A' ' 29' ' ' ILE . 48.4 mt -92.99 103.62 14.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.46 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.477 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.0 m -83.1 145.64 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.136 0.493 . . . . 0.0 110.714 -178.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.75 122.41 6.65 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.103 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.529 ' HB3' HG21 ' A' ' 68' ' ' THR . 68.5 mt -98.98 11.62 38.41 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.925 0.426 . . . . 0.0 110.188 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 m -57.42 -25.16 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.675 -174.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -98.37 6.47 47.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.158 0.504 . . . . 0.0 111.015 -176.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.0 mt -125.25 107.02 17.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -84.63 21.19 1.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.817 0.341 . . . . 0.0 111.792 -174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -157.77 81.58 0.87 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.16 0.505 . . . . 0.0 109.769 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 62' ' ' LEU . 10.2 p -114.21 9.08 17.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.908 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 41.7 m-20 -79.49 2.67 21.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.115 0.483 . . . . 0.0 111.292 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -82.29 -13.7 56.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.576 170.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.8 tp -76.2 130.63 38.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.468 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.568 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 4.2 mtpm? -106.02 165.12 11.44 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.393 -177.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -89.96 123.8 34.19 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 175.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.503 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 98.01 37.5 4.38 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.754 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.568 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 67.4 mm-40 -116.61 175.75 5.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 111.74 -174.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HG2' ' CD2' ' A' ' 19' ' ' TYR . 52.9 mtpt -124.44 123.57 40.44 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.182 177.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.5 pt -135.41 153.76 34.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.622 0.725 . . . . 0.0 112.294 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 98' ' ' GLU . 56.0 tttm -110.39 106.52 15.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.588 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 26.7 m -94.56 154.29 3.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.148 0.499 . . . . 0.0 112.179 -172.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.7 m0 -118.47 104.13 10.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.455 175.534 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.547 ' HB3' HG22 ' A' ' 94' ' ' ILE . 53.1 p90 -117.67 145.48 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.08 0.467 . . . . 0.0 110.637 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -99.29 -39.19 8.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.4 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 38.4 m -120.34 124.32 45.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.274 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -117.85 118.69 32.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.822 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -117.84 115.86 25.82 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.084 0.468 . . . . 0.0 109.76 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.517 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 36.2 mt-10 -87.95 85.61 7.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.286 0.565 . . . . 0.0 110.544 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 m -91.23 -6.62 53.08 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.633 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 50.1 t30 66.68 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.538 -176.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 61.4 Cg_endo -75.01 156.35 99.91 Favored 'Cis proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.375 -1.51 . . . . 0.0 112.641 -0.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.3 Cg_exo -61.28 141.2 92.2 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.914 2.409 . . . . 0.0 112.686 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.9 t -132.29 141.51 49.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.863 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.442 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -138.32 130.78 29.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.668 0.27 . . . . 0.0 110.775 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.6 m -83.68 119.76 25.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.547 HG22 ' HB3' ' A' ' 81' ' ' PHE . 44.9 pt -102.66 150.4 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.85 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.66 -48.96 4.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.101 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -140.67 169.7 17.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.457 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -155.72 158.11 37.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 0.0 110.895 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 78' ' ' LYS . 43.1 mt-10 -114.57 121.76 44.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.269 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 tp -72.9 121.48 20.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 121.049 0.452 . . . . 0.0 110.49 -177.168 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 75.2 mtp . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -90.74 130.24 36.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.791 0.329 . . . . 0.0 111.177 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -79.34 129.12 34.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.905 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.431 HD21 HG22 ' A' ' 32' ' ' THR . 1.5 tt -128.46 116.88 20.39 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.2 t -98.79 122.59 50.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 155.97 26.65 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.38 -178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.44 ' O ' ' HA ' ' A' ' 30' ' ' LEU . 83.7 m-85 -83.99 127.87 34.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.675 0.274 . . . . 0.0 111.012 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.405 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 16.1 t -81.25 96.49 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.0 m -97.02 -36.92 6.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.858 0.361 . . . . 0.0 111.257 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.667 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 81.1 mt -140.25 147.15 39.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -135.94 140.9 44.36 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.4 -177.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 34.8 t70 -121.0 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 46.9 t30 -82.32 -33.88 28.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.461 . . . . 0.0 110.169 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -95.3 -33.16 12.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.848 -177.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -139.31 164.92 28.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.918 0.39 . . . . 0.0 111.35 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.534 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.72 133.79 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.978 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 57' ' ' ILE . 71.0 mt -90.65 107.04 18.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.026 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 40.6 mt -112.83 136.81 52.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.619 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.586 HG22 ' H ' ' A' ' 33' ' ' ASP . 41.4 mt -95.33 120.04 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 174.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.431 HG22 HD21 ' A' ' 16' ' ' LEU . 20.6 p -90.25 22.89 3.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.969 -175.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.586 ' H ' HG22 ' A' ' 31' ' ' ILE . 7.4 t70 -97.31 -167.07 1.48 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.266 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -99.26 -23.44 15.19 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.222 0.534 . . . . 0.0 110.707 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -87.1 140.02 29.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.923 -177.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -98.84 130.98 26.46 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 168.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.475 ' HB3' ' CB ' ' A' ' 41' ' ' ASP . 57.3 Cg_exo -53.76 150.11 30.47 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.959 2.439 . . . . 0.0 112.876 -177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.72 -171.54 35.94 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.635 -0.793 . . . . 0.0 111.996 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.06 -42.88 77.3 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 122.614 0.366 . . . . 0.0 110.843 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.633 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.8 mt-10 -65.4 -41.22 93.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.944 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.475 ' CB ' ' HB3' ' A' ' 37' ' ' PRO . 16.0 m-20 -65.07 -44.74 87.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.414 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -68.96 -19.08 64.16 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.863 0.363 . . . . 0.0 111.201 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.84 -23.68 23.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.547 -178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.0 mt -69.03 158.69 34.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.136 178.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -70.78 149.08 47.23 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -59.99 -31.64 70.11 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -172.651 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.01 -37.83 93.53 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.118 177.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 96.8 mt-30 -66.72 -49.04 67.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 177.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.83 -40.91 96.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.413 178.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 45.7 ttm -61.54 -33.77 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.785 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -81.19 -28.69 34.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.857 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 58.2 mtpt -64.18 -39.14 93.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.094 0.473 . . . . 0.0 110.291 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -113.46 43.39 1.77 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.64 178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -48.3 -37.71 17.07 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -116.72 13.53 15.16 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.346 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -121.91 25.13 9.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.352 0.596 . . . . 0.0 109.491 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.77 HD11 HG23 ' A' ' 29' ' ' ILE . 10.2 tt -130.14 139.12 52.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.688 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.7 t -127.76 123.81 61.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' A' ' 91' ' ' SER . 58.6 mt -94.83 103.06 14.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.1 m -84.1 144.77 9.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.048 0.451 . . . . 0.0 111.329 -175.291 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.19 122.57 6.36 Favored Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.649 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.552 HD22 HG21 ' A' ' 68' ' ' THR . 63.4 mt -95.25 -4.03 46.47 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.778 0.34 . . . . 0.0 110.536 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 m -59.26 -24.68 63.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.489 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -76.69 -38.58 54.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.49 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.442 HG22 ' H ' ' A' ' 67' ' ' ASN . 45.9 mt -106.68 100.14 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.996 0.427 . . . . 0.0 110.887 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -80.23 8.36 7.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.148 0.499 . . . . 0.0 110.7 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.442 ' H ' HG22 ' A' ' 65' ' ' ILE . 86.5 m-20 -104.02 12.51 34.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.838 -177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.552 HG21 HD22 ' A' ' 62' ' ' LEU . 5.3 p -81.84 26.03 0.52 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -70.2 -36.63 74.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.868 0.366 . . . . 0.0 111.301 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.63 6.05 29.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.252 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.536 HD11 HD13 ' A' ' 77' ' ' ILE . 14.3 tp -71.54 115.83 11.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.944 0.402 . . . . 0.0 110.079 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 43.3 tttm -100.9 140.86 34.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.512 -174.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 74.1 mtt180 -72.78 152.53 41.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.283 173.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.29 41.39 38.24 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.696 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -143.24 -166.05 2.22 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HB2' ' A' ' 100' ' ' LEU . 63.1 pttt -144.28 145.45 32.03 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 99' ' ' LEU . 25.5 pt -135.47 152.08 31.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.268 0.556 . . . . 0.0 111.313 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -104.8 106.71 17.32 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.844 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 30.7 m -103.92 155.58 5.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.881 0.372 . . . . 0.0 111.434 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 6.6 m-90 -113.43 111.59 22.21 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.432 172.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 2.4 p90 -115.43 163.66 15.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.36 -175.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.34 -60.84 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -93.45 133.4 36.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.152 0.501 . . . . 0.0 111.547 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -115.91 117.11 29.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.365 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.713 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 67.2 mttm -85.97 135.28 33.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.962 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -92.6 42.52 1.1 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.995 -173.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.9 t -68.65 -31.84 71.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.843 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 48.6 t30 64.39 102.38 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.428 0 O-C-N 123.611 0.569 . . . . 0.0 110.705 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 27.2 Cg_exo -63.18 152.12 69.66 Favored 'Cis proline' 0 C--N 1.347 0.452 0 C-N-CA 124.076 -1.218 . . . . 0.0 113.022 2.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 45.6 Cg_exo -55.95 130.1 38.52 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.015 2.477 . . . . 0.0 112.275 -178.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.713 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 13.3 m -105.44 116.06 31.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.082 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -104.09 116.05 31.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.731 0.3 . . . . 0.0 111.215 -176.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.1 m -76.88 114.6 15.84 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.9 pt -96.65 139.04 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.915 0.388 . . . . 0.0 111.192 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -104.81 -25.87 12.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.786 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -147.72 163.64 36.06 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.639 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 2.6 p90 -162.01 150.35 15.0 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.989 0.423 . . . . 0.0 111.572 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -114.75 123.09 48.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.763 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.542 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -75.32 110.97 10.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.088 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.529 ' HB2' ' HG3' ' A' ' 76' ' ' LYS . 86.3 mt . . . . . 0 C--N 1.326 -0.44 0 CA-C-O 121.105 0.479 . . . . 0.0 110.679 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.494 ' HB2' ' HB3' ' A' ' 80' ' ' TRP . 61.5 mtm . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.945 0.402 . . . . 0.0 111.594 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -83.2 126.81 33.04 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.675 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.2 m -91.61 132.12 36.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.891 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.438 HD12 HG22 ' A' ' 32' ' ' THR . 0.2 OUTLIER -137.26 130.3 30.68 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.399 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.22 126.41 52.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.68 169.15 29.23 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.218 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.476 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 87.7 m-85 -103.25 135.51 44.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.849 0.357 . . . . 0.0 110.769 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.77 96.18 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.046 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.5 t -96.11 -53.32 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.608 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.85 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 92.8 mt -116.5 136.19 53.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.977 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -126.88 130.18 49.67 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.209 0.528 . . . . 0.0 111.01 -178.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.38 175.53 5.47 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -74.49 -34.33 63.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -119.23 -0.32 11.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.579 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -143.18 165.29 27.84 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 -175.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.429 ' HB3' ' CG2' ' A' ' 60' ' ' VAL . . . -138.89 122.31 17.21 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.859 0.362 . . . . 0.0 110.074 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.85 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 53.6 mt -90.9 99.33 9.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.243 0.544 . . . . 0.0 109.637 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.7 mt -108.94 139.08 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.711 -173.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.3 mt -87.67 114.21 26.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.438 HG22 HD12 ' A' ' 16' ' ' LEU . 6.0 p -80.08 -16.19 55.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.05 119.42 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' HE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -80.56 69.85 7.15 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -171.186 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -128.99 120.31 25.82 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 168.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -67.15 114.12 16.87 Favored Pre-proline 0 C--N 1.327 -0.377 0 O-C-N 123.109 0.256 . . . . 0.0 110.799 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 11.4 Cg_exo -70.92 156.99 59.34 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 123.016 2.477 . . . . 0.0 112.158 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.22 -178.09 34.46 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.769 178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -58.25 -38.51 77.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.905 0.383 . . . . 0.0 110.746 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.6 mp0 -60.93 -40.44 93.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.474 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -72.92 -34.73 66.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.542 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -72.9 -20.08 61.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.613 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -82.1 -26.14 33.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.032 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.0 mt -61.96 145.17 53.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.5 m -88.32 -179.83 6.2 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.999 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.553 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 23.7 mp0 -54.24 -61.48 2.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.57 -172.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.23 -34.2 83.43 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.536 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.38 -41.26 89.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.838 0.352 . . . . 0.0 110.287 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.2 -33.36 65.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.657 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.564 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 66.1 mtt -64.4 -24.42 67.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.415 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -90.35 -31.5 16.87 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.5 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -78.37 -38.9 40.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.184 0.516 . . . . 0.0 110.261 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -113.59 55.39 0.72 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 50' ' ' MET . 20.8 tttt -61.38 112.67 2.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.469 -171.823 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 65.45 11.68 7.56 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.786 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -107.9 9.08 28.82 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.771 0.796 . . . . 0.0 109.199 174.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.562 HD11 HG22 ' A' ' 29' ' ' ILE . 18.8 tt -123.99 132.52 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.117 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.522 HG22 ' HB2' ' A' ' 90' ' ' PRO . 98.7 t -120.07 125.85 74.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.994 0.426 . . . . 0.0 110.981 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 HG12 ' A' ' 29' ' ' ILE . 56.4 mt -91.85 96.43 6.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.429 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.0 m -76.01 147.54 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.211 0.529 . . . . 0.0 110.704 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.87 119.87 6.14 Favored Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.769 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD13 HG21 ' A' ' 68' ' ' THR . 64.6 mt -89.1 27.08 1.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -38.25 80.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.371 -176.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.708 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 26.0 mm-40 -92.72 -9.38 40.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.687 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.422 HG22 HG23 ' A' ' 68' ' ' THR . 50.2 mt -117.36 104.64 16.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.044 0.449 . . . . 0.0 111.008 -175.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -82.23 -38.59 24.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.731 -178.115 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -81.01 47.99 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.446 0.641 . . . . 0.0 111.252 -175.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.531 HG21 HD13 ' A' ' 62' ' ' LEU . 2.2 p -85.36 18.39 2.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.573 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -73.99 -24.74 59.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.576 174.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.14 -26.33 65.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.928 174.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -83.42 121.48 27.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -119.29 165.53 14.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.903 0.382 . . . . 0.0 110.821 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -83.76 127.42 33.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.81 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.74 42.48 2.47 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.068 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -134.06 -171.15 2.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.177 0.513 . . . . 0.0 111.455 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 19' ' ' TYR . 83.6 tttt -138.69 129.52 26.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.107 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 pt -136.74 166.65 25.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.663 0.744 . . . . 0.0 112.586 -175.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HB2' HD11 ' A' ' 100' ' ' LEU . 55.8 tttt -122.56 106.98 11.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.309 177.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.527 ' HB ' HG21 ' A' ' 94' ' ' ILE . 30.1 m -98.41 149.34 5.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 120.988 0.423 . . . . 0.0 112.139 -171.406 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 13' ' ' MET . 5.6 m-90 -114.53 106.23 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.393 172.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.459 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.8 p90 -108.97 135.31 50.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.32 0.581 . . . . 0.0 111.106 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -91.61 -48.9 6.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.454 ' CG2' ' HB ' ' A' ' 93' ' ' THR . 8.6 t -104.68 126.64 51.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.281 0.562 . . . . 0.0 110.243 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -112.39 138.46 49.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.164 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.673 ' HB2' ' HB3' ' A' ' 91' ' ' SER . 58.9 mttm -118.04 134.28 55.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.0 0.428 . . . . 0.0 110.379 -178.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -110.02 56.5 0.62 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.485 0.659 . . . . 0.0 109.544 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 p -73.23 -23.36 60.35 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.53 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 63.87 99.78 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.629 0 C-N-CA 123.252 0.621 . . . . 0.0 111.293 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 34.0 Cg_endo -63.73 147.22 63.4 Favored 'Cis proline' 0 C--N 1.349 0.564 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.585 1.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 58' ' ' VAL . 34.8 Cg_exo -57.14 152.67 43.45 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.03 2.486 . . . . 0.0 113.082 -176.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB3' ' HB2' ' A' ' 85' ' ' LYS . 26.3 t -134.81 161.06 36.26 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.357 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.26 110.08 2.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.618 0.246 . . . . 0.0 110.599 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.454 ' HB ' ' CG2' ' A' ' 83' ' ' THR . 38.5 m -73.89 113.64 11.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.912 0.387 . . . . 0.0 110.09 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.527 HG21 ' HB ' ' A' ' 79' ' ' VAL . 31.8 pt -100.03 138.4 24.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.008 -177.316 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.708 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 39.7 mt-30 -104.85 -10.87 17.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.246 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -159.74 144.16 14.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.491 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.415 ' CD1' HD13 ' A' ' 65' ' ' ILE . 5.1 p90 -147.59 152.73 38.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.015 0.435 . . . . 0.0 111.12 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -114.56 144.17 43.81 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.092 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 51.2 tp -93.25 136.62 33.35 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 -178.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.6 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 120.772 0.32 . . . . 0.0 110.182 178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.46 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 67.5 mtm . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -83.85 125.89 32.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.717 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.5 t -109.55 141.16 42.44 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.378 -173.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 78' ' ' LYS . 67.9 mt -139.41 146.82 40.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.276 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.7 t -97.08 127.96 48.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 171.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 157.47 27.31 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.819 -176.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.403 ' HE1' ' HE3' ' A' ' 76' ' ' LYS . 65.3 m-85 -94.66 125.51 39.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.465 -0.368 . . . . 0.0 110.308 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.51 104.73 11.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.47 HG11 HD21 ' A' ' 49' ' ' LEU . 7.1 p -100.66 -42.04 9.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.861 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 66.8 mt -129.34 154.81 46.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.644 0.259 . . . . 0.0 110.42 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -148.44 142.11 25.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.09 0.471 . . . . 0.0 111.171 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.425 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 13.8 t70 -123.14 -155.72 0.67 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 171.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.425 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 6.9 t30 -102.76 -31.3 10.39 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -91.66 -35.61 14.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.92 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -135.88 165.64 25.16 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.171 -174.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.37 149.69 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.751 174.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.747 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 42.0 mt -106.41 111.55 35.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.957 0.408 . . . . 0.0 110.488 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.76 141.94 44.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.462 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.3 mt -106.71 118.79 55.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.3 p -79.65 120.66 24.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.231 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 60.82 -162.43 0.27 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.665 0.603 . . . . 0.0 110.379 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m 76.94 14.26 2.06 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.314 174.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 62.96 -174.62 0.15 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.356 -178.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -84.09 135.42 42.12 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.292 178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 32.2 Cg_exo -58.9 158.47 24.76 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.903 2.402 . . . . 0.0 112.452 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.5 174.08 55.15 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.266 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -62.07 -39.84 93.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.9 mp0 -65.05 -34.14 77.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.326 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -64.64 -36.6 84.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.698 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -75.57 -5.02 43.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.02 0.438 . . . . 0.0 111.042 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -109.16 -8.24 15.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.65 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.1 mt -76.34 148.48 37.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 175.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -75.69 165.05 25.63 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.669 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -55.09 -47.45 74.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.537 -173.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.02 93.73 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.608 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.86 -44.82 96.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 0.0 110.624 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 21' ' ' VAL . 25.1 tp -62.78 -43.94 97.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.724 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.41 ' HG2' ' CD1' ' A' ' 57' ' ' ILE . 87.3 mtp -64.68 -22.98 67.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.428 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -93.49 -9.56 37.98 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.54 -50.7 5.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.998 0.427 . . . . 0.0 110.339 179.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -102.55 40.07 1.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -57.83 -29.78 65.21 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.897 -169.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -93.94 -23.76 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -109.41 11.42 25.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.745 0.307 . . . . 0.0 111.615 -175.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CD1' ' HG2' ' A' ' 50' ' ' MET . 10.7 tt -91.65 125.04 44.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.3 0.571 . . . . 0.0 110.722 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.0 t -118.84 120.43 64.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.942 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 66.1 mt -92.43 101.88 13.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.202 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -86.22 140.1 16.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.226 0.536 . . . . 0.0 111.236 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -92.17 125.89 8.28 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.292 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HG21 ' A' ' 68' ' ' THR . 63.2 mt -94.44 14.43 20.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.091 0.472 . . . . 0.0 110.531 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -60.08 -28.46 67.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.845 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 17.3 mm-40 -89.39 -3.44 58.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.442 -176.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' ASN . 26.5 mt -119.58 117.67 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.105 0.479 . . . . 0.0 110.249 -177.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -86.12 7.83 23.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.403 0.621 . . . . 0.0 111.136 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' ILE . 23.5 t-20 -153.94 83.77 1.15 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.168 -176.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.525 HG21 HD22 ' A' ' 62' ' ' LEU . 1.2 p -119.77 13.16 12.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.445 0.64 . . . . 0.0 110.614 177.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -72.98 -9.12 58.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.764 -175.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -92.68 5.86 49.51 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.081 -0.387 . . . . 0.0 111.049 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.7 tp -90.57 140.85 29.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.221 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.494 ' HD3' ' CD ' ' A' ' 75' ' ' GLU . 6.6 mptt -124.58 -178.52 4.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -93.17 123.23 36.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.052 174.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.61 42.69 2.11 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.556 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.494 ' CD ' ' HD3' ' A' ' 72' ' ' LYS . 53.9 mt-10 -128.3 177.84 6.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.896 0.379 . . . . 0.0 110.947 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.403 ' HE3' ' HE1' ' A' ' 19' ' ' TYR . 59.9 mttp -121.05 135.19 55.25 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.463 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.2 pt -137.62 152.99 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.334 0.588 . . . . 0.0 111.483 177.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 82.8 tttt -110.2 107.28 17.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.605 176.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.717 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.3 m -95.17 154.65 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -170.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.46 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 12.7 m-90 -125.78 123.38 38.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.636 172.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.554 ' HB3' HG22 ' A' ' 94' ' ' ILE . 55.5 p90 -140.07 171.35 14.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.003 0.43 . . . . 0.0 111.089 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 62.8 t60 -147.27 -35.8 0.23 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.494 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 2.5 m -76.47 98.78 4.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.063 175.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.0 ttt180 -94.73 120.95 35.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.406 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -119.8 139.35 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -121.57 101.62 7.72 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.464 -0.495 . . . . 0.0 110.864 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.5 t -104.8 -11.66 16.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.311 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 49.4 t-20 65.65 99.51 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 O-C-N 124.078 0.861 . . . . 0.0 109.675 -174.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 68.6 Cg_endo -72.28 171.4 63.33 Favored 'Cis proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.004 -1.248 . . . . 0.0 113.227 3.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.73 140.61 84.7 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.02 2.48 . . . . 0.0 112.798 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.8 p -130.04 115.75 17.56 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.417 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.4 125.05 50.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.764 0.316 . . . . 0.0 110.884 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 24.3 m -84.62 107.56 16.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.313 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.554 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.0 pt -96.44 139.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.113 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -103.14 -5.32 23.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.539 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -173.26 151.34 2.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.734 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -143.84 163.4 33.49 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.61 120.99 42.06 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.463 ' HA ' HG22 ' A' ' 77' ' ' ILE . 37.0 tp -75.24 109.71 8.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.961 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 43.5 mt . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 121.066 0.46 . . . . 0.0 110.533 -176.564 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.532 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 53.1 mtp . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.885 0.374 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 13.4 mp0 -83.79 161.63 20.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.055 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 m -102.85 128.66 49.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 0.0 111.45 -175.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.617 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 4.7 tt -116.7 109.5 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.8 t -93.9 117.78 38.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 158.69 27.77 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.473 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -96.25 127.82 42.61 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.0 t -75.92 97.3 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -103.4 -37.5 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -176.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 29' ' ' ILE . 36.8 tp -136.26 126.69 26.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' HB2' ' A' ' 71' ' ' LEU . 62.4 tttm -146.46 125.54 12.88 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.664 -177.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -70.41 0.57 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.106 0.479 . . . . 0.0 110.245 176.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -154.68 -60.59 0.12 Allowed 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -97.61 -20.2 17.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.928 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 27' ' ' ARG . 19.8 mtm180 -104.13 123.88 48.08 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.967 0.413 . . . . 0.0 110.954 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.521 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -111.05 112.92 25.08 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.956 176.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.736 HD12 HD23 ' A' ' 22' ' ' LEU . 54.1 mt -86.03 109.46 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.473 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.22 143.01 42.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.688 -175.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.9 mt -104.97 123.0 58.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -76.78 101.23 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.548 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.3 t70 64.28 101.77 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.812 0.695 . . . . 0.0 111.364 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.15 -7.24 4.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.36 40.2 29.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -174.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.25 102.84 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.289 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.503 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -50.72 -63.52 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.186 2.591 . . . . 0.0 112.849 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.7 148.69 5.44 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.757 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -61.21 -37.71 83.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.477 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.8 -26.64 44.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.5 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 2.3 m-20 -65.41 -32.2 73.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.762 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -69.66 -14.19 62.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.918 0.389 . . . . 0.0 110.63 176.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -99.6 -18.07 17.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' HA ' ' A' ' 41' ' ' ASP . 87.6 mt -63.26 149.91 44.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.029 0.442 . . . . 0.0 110.989 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -76.25 171.26 14.83 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.871 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 50' ' ' MET . 41.9 tt0 -56.27 -54.62 43.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.346 -176.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.03 -37.5 91.67 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.469 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -65.28 -43.37 91.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.984 0.421 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.5 mt -68.23 -40.02 82.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.948 177.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 85.5 mtp -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.998 -177.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.59 -34.12 14.15 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.974 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -76.66 -43.9 36.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.057 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -110.09 39.82 2.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.871 0.844 . . . . 0.0 109.107 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.419 ' O ' HG22 ' A' ' 57' ' ' ILE . 26.7 ttpt -53.93 -48.64 70.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.723 -170.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -86.51 0.52 54.1 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -175.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -124.98 17.99 8.5 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.709 -176.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 89' ' ' PRO . 13.6 tt -103.36 124.14 57.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.193 0.521 . . . . 0.0 111.74 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.534 HG22 ' HG2' ' A' ' 90' ' ' PRO . 70.1 t -124.33 137.54 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.301 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.657 HD12 HG12 ' A' ' 29' ' ' ILE . 13.3 mm -104.2 100.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.142 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.418 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.3 m -89.01 139.95 16.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.257 0.551 . . . . 0.0 111.046 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -94.36 117.2 5.47 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.948 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 68' ' ' THR . 49.0 mt -95.75 11.03 34.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.626 0.37 . . . . 0.0 110.562 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.1 m -63.93 -14.83 56.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.441 ' OE2' ' HG2' ' A' ' 95' ' ' GLN . 27.5 tt0 -96.72 -3.33 42.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.21 0.529 . . . . 0.0 110.418 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.463 ' CG2' HG23 ' A' ' 68' ' ' THR . 31.1 mt -113.23 109.92 30.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.91 11.36 9.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.814 -168.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -136.9 24.01 3.07 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 122.207 -0.308 . . . . 0.0 111.763 -177.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.556 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.7 p -80.43 37.73 0.41 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.78 -21.22 25.24 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.046 0.451 . . . . 0.0 110.623 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -73.95 -17.73 60.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.976 -174.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.521 ' HB2' ' HE3' ' A' ' 23' ' ' LYS . 3.2 mm? -71.31 122.79 20.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.745 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -108.01 171.19 7.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.424 -179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -86.4 117.9 25.5 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.43 33.56 2.68 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.759 -177.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.63 -177.48 4.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -135.13 135.0 40.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 -175.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 99' ' ' LEU . 32.1 pt -137.93 151.45 25.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.432 0.634 . . . . 0.0 111.7 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.438 ' HB2' HD11 ' A' ' 100' ' ' LEU . 47.9 tttm -115.33 106.75 14.38 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.541 172.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.447 ' CG2' ' HB3' ' A' ' 16' ' ' LEU . 30.1 m -100.77 154.15 4.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.323 -174.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.532 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.2 m-90 -104.81 119.46 39.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.642 174.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.617 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -136.79 171.99 13.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -164.57 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.465 -0.789 . . . . 0.0 108.892 175.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 0.2 OUTLIER -75.3 90.68 2.63 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.991 174.506 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 84' ' ' ARG . 23.0 ttt180 -108.45 117.84 35.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.131 0.491 . . . . 0.0 110.787 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -112.47 94.51 4.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.399 -0.819 . . . . 0.0 108.839 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.767 ' HG3' ' HB3' ' A' ' 90' ' ' PRO . 27.3 tt0 -85.47 109.71 18.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.362 0.601 . . . . 0.0 111.283 -173.023 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p -108.68 -11.63 15.05 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.583 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.0 t30 62.01 96.18 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.354 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.433 -173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.448 ' HB3' HG23 ' A' ' 57' ' ' ILE . 39.4 Cg_endo -66.63 144.1 66.91 Favored 'Cis proline' 0 C--N 1.344 0.317 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.677 1.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.767 ' HB3' ' HG3' ' A' ' 86' ' ' GLU . 41.4 Cg_endo -68.7 139.87 45.3 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.715 2.277 . . . . 0.0 112.656 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 29.8 t -111.28 153.45 25.9 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.21 131.18 19.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.682 0.277 . . . . 0.0 111.074 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 11.9 m -85.91 126.89 34.43 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.559 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.3 pt -117.47 153.04 19.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.519 -178.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HG2' ' OE2' ' A' ' 64' ' ' GLU . 80.0 mt-30 -110.6 -38.17 5.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.035 176.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -130.8 150.91 51.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.736 -172.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 1.7 p90 -152.07 154.1 35.27 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 0.0 110.712 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.411 ' OE2' ' HD3' ' A' ' 78' ' ' LYS . 42.0 mt-10 -117.21 114.34 23.51 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.502 175.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 77' ' ' ILE . 65.1 tp -71.38 104.41 3.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.438 HD11 ' HB2' ' A' ' 78' ' ' LYS . 73.1 mt . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 69.3 mtp . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -83.84 119.56 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.321 -177.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.9 t -83.59 109.89 17.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 -178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD11 HG22 ' A' ' 32' ' ' THR . 3.2 tm? -116.52 119.31 35.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.693 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.444 HG22 ' HG3' ' A' ' 78' ' ' LYS . 30.5 t -94.08 129.65 44.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 162.8 28.93 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.656 -176.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.414 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 94.8 m-85 -100.89 126.46 47.51 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.71 91.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.705 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.494 HG23 ' CE1' ' A' ' 42' ' ' TYR . 2.9 p -93.15 -39.48 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.674 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.745 HD23 HD12 ' A' ' 29' ' ' ILE . 39.8 tp -130.27 133.01 46.18 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -131.37 137.47 48.74 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.827 0.346 . . . . 0.0 110.338 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.16 -176.98 3.24 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.22 -37.68 52.84 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -94.54 -37.31 11.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.782 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -137.56 174.75 10.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.983 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.419 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.89 149.24 33.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.511 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.745 HD12 HD23 ' A' ' 22' ' ' LEU . 42.3 mt -106.25 115.92 48.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.078 178.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.0 mt -110.09 138.48 46.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.404 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.8 mt -95.21 118.51 41.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.533 HG22 HD11 ' A' ' 16' ' ' LEU . 14.5 p -79.93 89.7 5.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.226 -174.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.414 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 38.5 t70 55.5 86.91 0.05 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.442 171.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -148.44 31.63 0.81 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.521 0.677 . . . . 0.0 110.064 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 63.91 28.05 14.5 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.269 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.44 150.9 0.11 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.67 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.483 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 95.3 Cg_endo -81.26 161.41 20.17 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.205 1.937 . . . . 0.0 111.559 173.647 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.86 173.29 30.52 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.145 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -58.78 -28.43 65.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.278 0.561 . . . . 0.0 109.714 177.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.59 -38.85 75.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.89 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 54.6 m-20 -81.17 -28.34 35.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.37 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . 0.494 ' CE1' HG23 ' A' ' 21' ' ' VAL . 91.7 m-85 -74.02 -18.88 60.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.129 0.49 . . . . 0.0 109.841 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -80.43 -37.21 32.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.177 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 78.8 mt -64.1 162.0 15.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.27 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.9 m -81.54 162.97 22.97 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -32.96 72.52 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.292 -173.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.78 -41.55 93.58 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.14 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.43 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 93.7 mt-30 -66.73 -38.01 85.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 110.193 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.8 tp -68.66 -40.66 80.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.008 175.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.542 ' HG3' HD13 ' A' ' 57' ' ' ILE . 47.9 ttm -61.54 -29.42 69.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -81.74 -35.14 30.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.97 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -71.98 -52.26 17.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.919 0.39 . . . . 0.0 110.683 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -95.35 46.39 1.11 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.515 0.674 . . . . 0.0 109.321 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.1 tttp -53.37 -35.08 59.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.362 -1.29 . . . . 0.0 113.247 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -109.04 1.31 20.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -120.71 7.16 10.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.608 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.542 HD13 ' HG3' ' A' ' 50' ' ' MET . 10.9 tt -93.43 123.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.968 -179.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.25 129.36 73.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.281 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.446 HG12 HG12 ' A' ' 29' ' ' ILE . 59.7 mt -95.57 108.2 20.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.834 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.77 142.98 12.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.262 0.553 . . . . 0.0 111.326 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.31 115.99 4.51 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.816 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.506 HD22 HG21 ' A' ' 68' ' ' THR . 69.8 mt -105.18 -4.8 21.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.735 0.303 . . . . 0.0 110.665 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.5 m -62.98 -29.21 70.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.321 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -90.65 9.56 29.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.121 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.448 HD12 HG13 ' A' ' 94' ' ' ILE . 58.2 mt -137.72 95.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 174.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -75.16 -9.66 58.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -176.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -89.81 33.5 0.85 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.641 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.506 HG21 HD22 ' A' ' 62' ' ' LEU . 8.0 p -101.93 21.17 15.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.131 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -80.6 -31.26 36.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.522 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -74.16 -10.57 59.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.583 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.4 tp -71.87 119.82 16.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.919 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -99.39 144.46 28.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.507 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -77.63 133.01 38.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.75 48.29 3.7 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -175.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HG2' HD11 ' A' ' 99' ' ' LEU . 6.0 tp10 -140.98 171.44 14.07 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -116.19 139.19 50.6 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.1 pt -139.36 154.68 25.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.27 0.557 . . . . 0.0 111.587 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.444 ' HG3' HG22 ' A' ' 17' ' ' VAL . 38.4 ttpt -116.58 107.0 14.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.168 -0.923 . . . . 0.0 108.899 174.13 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 25.3 m -96.85 158.96 3.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.042 0.449 . . . . 0.0 111.59 -173.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 3.3 m-90 -126.39 122.02 34.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.225 173.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -133.28 158.1 43.78 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.183 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -112.72 -12.19 13.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.06 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.9 m -141.11 137.18 32.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.165 -176.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.2 mtm-85 -112.38 140.48 47.06 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 174.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.787 ' HB3' ' HB2' ' A' ' 91' ' ' SER . 82.6 tttt -84.44 117.68 23.8 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 104.43 1.72 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.362 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.8 p -162.09 176.36 10.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.356 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 12.8 m120 -134.17 110.57 11.79 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.698 175.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 11.5 Cg_exo -71.36 156.25 96.84 Favored 'Cis proline' 0 C--O 1.235 0.368 0 C-N-CA 123.772 -1.345 . . . . 0.0 112.609 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.7 138.79 87.7 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.703 2.268 . . . . 0.0 112.149 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.787 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 21.6 m -112.54 158.32 20.08 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.273 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -150.79 101.38 2.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.887 0.375 . . . . 0.0 111.289 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 27.4 m -71.19 115.54 10.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 65' ' ' ILE . 37.7 pt -89.8 154.24 3.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.261 0.553 . . . . 0.0 111.736 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -104.76 -23.0 13.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.203 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 97' ' ' TYR . 51.6 tttt -162.32 159.56 25.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.318 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 30.2 p90 -148.89 157.67 43.6 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 175.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -114.48 116.25 28.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.74 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -72.48 108.76 5.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.937 179.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.287 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.401 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 61.3 mtm . . . . . 0 CA--C 1.519 -0.228 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -87.14 116.77 25.43 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.634 ' HB3' ' CD1' ' A' ' 80' ' ' TRP . 17.8 p -94.15 133.85 37.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.728 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.402 HD12 HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -133.75 130.86 38.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.602 176.78 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -93.74 133.11 35.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.195 179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -155.66 167.64 33.14 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.301 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -97.0 134.08 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.635 0.255 . . . . 0.0 110.776 178.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.2 t -83.64 106.36 14.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 25.5 m -104.34 -34.8 3.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.882 0.372 . . . . 0.0 111.552 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.724 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 84.8 mt -135.82 140.38 44.19 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -136.42 119.26 16.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.431 0.634 . . . . 0.0 111.901 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 18.7 t70 -97.54 176.33 5.9 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 170.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -64.21 -38.77 92.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.653 0.264 . . . . 0.0 110.453 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -107.65 -41.31 5.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.692 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 51.1 mtm-85 -104.2 115.8 31.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.108 0.48 . . . . 0.0 112.215 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.455 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -100.96 121.97 42.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.873 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.724 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 67.6 mt -91.3 110.83 22.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.011 -178.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 mt -109.87 147.34 33.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.749 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.6 mt -104.8 113.34 41.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.149 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HD12 ' A' ' 16' ' ' LEU . 10.2 p -90.65 -19.18 23.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.621 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 34.2 t70 -65.99 119.49 11.44 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 172.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.5 m -75.85 85.96 2.82 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.788 0.804 . . . . 0.0 112.07 -170.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -140.23 136.58 33.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.592 -1.186 . . . . 0.0 108.635 172.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -72.13 118.2 65.1 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 5.2 Cg_exo -78.81 115.61 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.603 2.202 . . . . 0.0 111.431 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 -163.66 25.18 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.774 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.36 -44.17 79.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.547 0.213 . . . . 0.0 111.206 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -67.78 -32.75 73.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.821 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -65.47 -36.76 84.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.125 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -85.72 -6.13 59.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -88.03 -26.49 22.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 110.319 176.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.33 147.54 47.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.212 177.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 57.3 p -75.67 161.53 29.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.348 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -53.17 -41.86 65.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.559 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.11 -53.15 48.1 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.491 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.91 -37.22 86.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.101 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.6 tp -61.23 -44.34 97.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.327 0.584 . . . . 0.0 109.849 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 51.9 ttm -70.86 -20.41 62.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.074 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.31 -38.63 63.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.197 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -79.61 -48.9 13.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.888 0.375 . . . . 0.0 110.94 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -91.27 23.67 3.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.837 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.409 ' HG2' HD21 ' A' ' 88' ' ' ASN . 84.3 tttt -50.16 -42.26 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -171.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -98.45 12.1 36.1 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 16.0 t-20 -154.49 34.44 0.41 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.322 0.582 . . . . 0.0 111.19 -177.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.6 tt -119.8 132.43 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.406 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.5 t -121.47 125.35 73.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 0.0 111.391 -174.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.8 mt -101.35 114.87 41.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 27.1 m -98.89 145.16 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.187 0.518 . . . . 0.0 111.373 -176.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -95.14 114.22 4.8 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.045 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 68' ' ' THR . 42.4 mt -87.06 4.77 40.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.048 0.451 . . . . 0.0 109.914 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -56.84 -37.24 70.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.51 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -85.23 -7.21 59.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 0.0 110.997 -178.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.9 mt -94.53 -39.24 10.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.681 176.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 76.08 -37.98 0.32 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.351 172.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -130.27 87.83 2.56 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.385 0.612 . . . . 0.0 109.658 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.538 ' HB ' HD13 ' A' ' 62' ' ' LEU . 4.0 m -119.62 24.58 10.54 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 174.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -18.36 52.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.541 -1.663 . . . . 0.0 113.202 -172.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -66.67 -27.5 67.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.922 0.391 . . . . 0.0 110.606 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 77' ' ' ILE . 3.6 mp -73.81 145.29 45.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.342 0.591 . . . . 0.0 111.8 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -119.47 157.88 27.38 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.197 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 73' ' ' ARG . 7.9 ptt180 -76.94 71.7 3.46 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.105 0.955 . . . . 0.0 110.768 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 162.48 48.7 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -138.06 -173.88 3.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.187 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -126.98 124.75 40.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.757 -176.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.622 HG21 HD21 ' A' ' 71' ' ' LEU . 42.8 pt -136.34 166.85 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.644 0.735 . . . . 0.0 112.43 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -131.31 106.94 8.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.46 -1.245 . . . . 0.0 108.562 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.4 m -95.86 150.73 4.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.634 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 5.4 m-90 -116.11 118.31 32.5 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.736 173.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.539 ' HB3' HG22 ' A' ' 94' ' ' ILE . 19.0 p90 -124.77 176.62 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.105 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -93.71 -43.14 8.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.927 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -162.76 177.85 8.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.456 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -123.68 136.0 54.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.914 0.388 . . . . 0.0 111.0 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -99.13 97.65 8.74 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HG2' ' HG3' ' A' ' 90' ' ' PRO . 1.5 tm-20 -87.36 87.89 7.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.256 0.551 . . . . 0.0 110.141 -174.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.5 p -108.02 2.89 23.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.251 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 27.1 t-20 60.18 101.11 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.364 -177.2 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 73.9 Cg_endo -75.98 152.38 96.6 Favored 'Cis proline' 0 CA--C 1.53 0.325 0 C-N-CA 123.29 -1.546 . . . . 0.0 112.658 -0.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.509 ' HG3' ' HG2' ' A' ' 86' ' ' GLU . 31.9 Cg_exo -59.09 120.54 8.46 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.646 2.231 . . . . 0.0 112.003 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.6 m -105.69 142.69 34.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.635 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -142.37 121.79 13.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.85 0.357 . . . . 0.0 111.443 -177.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.6 m -81.49 110.05 16.53 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.539 HG22 ' HB3' ' A' ' 81' ' ' PHE . 37.8 pt -96.43 155.49 3.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.608 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.35 -29.43 5.5 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.464 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -135.03 155.17 51.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.885 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -153.7 148.1 26.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.178 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.458 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 34.3 tt0 -114.69 119.71 37.65 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 53.6 tp -78.6 119.5 21.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.504 -177.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 98.1 mt . . . . . 0 C--N 1.321 -0.638 0 CA-C-O 121.132 0.491 . . . . 0.0 110.367 -179.229 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.462 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 75.6 mtm . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -83.63 116.78 22.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -175.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.566 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 10.8 t -107.94 139.5 42.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.013 -169.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.431 HD12 ' C ' ' A' ' 15' ' ' SER . 6.0 mp -138.47 163.32 32.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.298 174.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -95.71 140.42 17.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 136.84 6.09 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.055 -1.069 . . . . 0.0 112.468 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -90.25 124.47 34.9 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.966 0.412 . . . . 0.0 110.115 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.9 t -82.01 104.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.983 -177.269 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 HD21 ' A' ' 49' ' ' LEU . 15.9 m -100.98 -41.28 8.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.177 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.705 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.1 mt -130.23 146.1 51.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 110.515 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -132.85 123.54 26.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.314 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 67.6 m-20 -101.33 -2.91 29.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 174.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 t30 75.63 -55.59 0.62 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.478 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.71 -18.91 50.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.599 0.714 . . . . 0.0 109.186 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 14.7 mtm180 -135.16 159.74 40.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.802 175.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.75 127.61 31.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.055 0.455 . . . . 0.0 110.518 175.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.705 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 56.9 mt -95.4 101.53 12.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.456 HD22 HG22 ' A' ' 20' ' ' VAL . 32.4 mt -115.05 140.91 48.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.124 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -90.67 111.47 23.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -83.2 -9.34 59.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.306 0.574 . . . . 0.0 110.979 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -90.38 157.58 17.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.324 176.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.9 p -89.53 3.44 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -172.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.42 93.92 4.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 109.898 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.97 128.1 92.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.435 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 96.3 Cg_endo -78.94 -178.93 5.01 Favored 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 123.008 2.472 . . . . 0.0 112.671 -178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.66 -176.37 20.62 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.521 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -68.38 -23.12 64.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.968 0.414 . . . . 0.0 110.637 -177.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 27.3 mp0 -70.81 -38.41 73.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.377 177.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 7.8 m-20 -65.17 -38.54 90.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.491 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -65.94 -19.03 65.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.889 0.376 . . . . 0.0 111.018 175.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -89.43 -20.48 23.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.939 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 99.2 mt -74.76 153.37 38.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 177.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.2 p -77.68 168.68 19.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.52 ' HG3' HD13 ' A' ' 22' ' ' LEU . 1.6 mp0 -53.77 -42.65 68.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.77 178.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.53 -49.33 70.24 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.222 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.432 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 77.9 mm-40 -64.11 -43.52 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.928 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.519 HD21 HG21 ' A' ' 21' ' ' VAL . 29.1 tp -64.31 -47.23 80.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.245 -177.311 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.458 ' SD ' HD11 ' A' ' 59' ' ' ILE . 68.3 mtm -75.82 -13.36 60.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.484 -177.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -89.07 -35.44 16.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.086 0.47 . . . . 0.0 110.295 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -73.38 -49.22 28.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.349 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.58 47.12 0.93 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -59.12 121.02 10.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.794 -172.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 69.35 4.83 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.041 -0.981 . . . . 0.0 112.358 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -104.83 5.59 33.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.585 0.707 . . . . 0.0 109.281 173.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.611 HD11 HG22 ' A' ' 29' ' ' ILE . 19.4 tt -126.04 140.14 49.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.697 -176.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -122.53 129.07 75.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.124 0.488 . . . . 0.0 111.086 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.458 HD11 ' SD ' ' A' ' 50' ' ' MET . 60.4 mt -94.91 107.76 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 175.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.484 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.5 m -88.91 145.2 7.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.255 0.55 . . . . 0.0 111.032 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.13 115.19 4.53 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.346 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 28' ' ' ALA . 87.2 mt -94.98 21.48 7.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.005 0.431 . . . . 0.0 110.307 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 27.2 p -60.6 -25.79 66.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.333 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -87.45 -9.31 54.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.011 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.439 HD11 ' HA ' ' A' ' 96' ' ' LYS . 47.7 mt -128.32 105.59 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.23 -177.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -81.66 -11.85 58.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.707 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -116.04 82.07 1.71 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.547 0.689 . . . . 0.0 109.813 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.588 HG21 HD13 ' A' ' 62' ' ' LEU . 38.4 p -111.14 17.68 20.11 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.219 -0.901 . . . . 0.0 108.606 174.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.88 -27.32 69.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.341 -1.3 . . . . 0.0 111.306 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.73 -23.48 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.065 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 23.9 tp -65.19 131.7 47.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -117.76 172.8 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.228 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 73' ' ' ARG . 23.8 mtm180 -98.0 137.56 36.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.809 0.338 . . . . 0.0 110.31 176.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.33 23.33 22.19 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -116.97 -173.12 2.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.075 0.464 . . . . 0.0 111.404 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HG2' HD12 ' A' ' 100' ' ' LEU . 78.3 tttt -141.82 123.21 14.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.972 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 pt -130.98 168.9 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.388 0.613 . . . . 0.0 112.004 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -116.48 117.84 31.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.08 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.566 ' O ' ' HA ' ' A' ' 15' ' ' SER . 26.8 m -104.29 148.69 8.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.511 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 6.8 m-90 -125.67 116.76 22.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.148 175.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.59 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.1 p90 -126.05 167.6 15.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 0.0 111.886 177.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.71 29.66 2.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.075 177.028 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -172.29 148.22 2.08 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.617 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -149.5 139.39 21.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -113.43 141.67 46.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.141 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.25 47.47 1.34 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.852 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.9 p -64.85 -37.82 88.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 55.57 93.95 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 O-C-N 123.875 0.735 . . . . 0.0 111.764 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 38.7 Cg_exo -60.98 135.38 14.62 Favored 'Cis proline' 0 C--N 1.354 0.824 0 C-N-CA 124.163 -1.182 . . . . 0.0 112.788 3.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 36.9 Cg_exo -59.43 141.45 97.53 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.125 2.55 . . . . 0.0 113.009 -175.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.0 p -116.22 151.09 36.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.89 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.34 119.15 9.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.741 0.305 . . . . 0.0 110.808 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 45.6 m -78.55 110.72 13.9 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.366 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.59 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.1 pt -96.13 143.76 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.659 -178.14 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -93.07 -28.81 16.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.615 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.439 ' HA ' HD11 ' A' ' 65' ' ' ILE . 67.8 mttm -150.89 159.58 44.46 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.339 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -147.65 147.6 30.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.595 176.484 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.511 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 28.0 tt0 -114.42 136.88 52.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.185 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.31 120.83 25.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.506 HD12 ' HG2' ' A' ' 76' ' ' LYS . 92.9 mt . . . . . 0 C--N 1.323 -0.563 0 CA-C-O 121.047 0.451 . . . . 0.0 110.209 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.1 mtp . . . . . 0 N--CA 1.45 -0.449 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.6 mt-30 -83.66 125.27 31.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.173 0.511 . . . . 0.0 110.442 -171.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.2 m -100.81 134.47 43.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.809 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.51 HD12 ' CE2' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -117.75 124.37 48.3 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 174.297 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.1 t -94.52 117.87 39.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.87 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.61 167.37 29.21 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.85 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.44 146.14 26.66 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.9 t -101.23 108.44 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.463 HG22 ' HG2' ' A' ' 37' ' ' PRO . 47.0 t -101.17 -59.66 3.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.856 0.36 . . . . 0.0 110.821 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.701 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 85.6 mt -116.65 159.51 22.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.405 -175.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -143.95 124.22 13.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.621 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 8.1 t70 -77.92 -66.4 0.85 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.124 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 49.3 t30 163.72 -60.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.662 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -90.62 -17.09 27.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.827 -1.078 . . . . 0.0 109.68 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -124.77 151.07 45.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.493 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.532 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -122.73 138.61 54.57 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.17 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.701 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 73.3 mt -99.05 104.08 15.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.913 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.8 mt -112.63 156.44 22.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.712 -172.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -106.39 109.0 26.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.229 171.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.0 p -83.84 72.55 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.8 0.809 . . . . 0.0 109.763 177.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -157.34 -167.36 2.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.606 -175.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -110.63 -11.98 14.38 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.952 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.68 132.43 46.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.057 0.456 . . . . 0.0 111.652 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -99.37 115.87 65.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.265 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HG2' HG22 ' A' ' 21' ' ' VAL . 18.1 Cg_exo -66.63 146.17 78.36 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.819 2.346 . . . . 0.0 112.169 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.77 -179.36 31.98 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.667 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.51 -40.07 81.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.849 0.357 . . . . 0.0 110.864 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.543 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.8 tt0 -64.3 -31.57 72.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -72.03 -35.03 69.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.833 0.349 . . . . 0.0 110.363 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.73 -25.07 61.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.063 0.459 . . . . 0.0 109.896 174.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -75.37 -27.91 59.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.139 176.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 95.7 mt -65.96 155.84 35.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.247 176.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.8 p -90.53 174.07 7.73 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.411 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.81 -50.96 55.16 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 123.41 0.444 . . . . 0.0 111.821 -176.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.62 -42.5 99.69 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.619 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -65.71 -39.1 90.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 0.0 110.254 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.31 -44.68 94.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.145 176.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.667 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 76.2 mtp -67.84 -18.35 64.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.967 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -91.56 -21.36 20.89 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.745 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -86.12 -51.32 6.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.328 0.585 . . . . 0.0 109.733 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -96.23 49.64 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' MET . 33.6 tttp -53.65 118.21 3.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.522 -170.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 64.89 10.34 6.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.584 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -106.31 15.26 26.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.753 0.787 . . . . 0.0 109.278 175.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.569 HD11 HG23 ' A' ' 29' ' ' ILE . 8.8 tt -107.97 135.53 46.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.335 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.536 HG22 ' HB2' ' A' ' 90' ' ' PRO . 74.6 t -126.76 131.66 70.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.854 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 72.2 mt -97.24 109.14 22.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 175.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.0 m -93.09 140.99 15.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.295 0.569 . . . . 0.0 111.318 -177.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.63 118.65 5.29 Favored Glycine 0 N--CA 1.442 -0.965 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.36 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.658 HD13 HG21 ' A' ' 68' ' ' THR . 11.0 mt -99.26 17.78 19.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.3 p -65.59 -14.23 60.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.685 -176.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -86.45 -12.45 49.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.004 0.43 . . . . 0.0 110.325 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.479 HG22 ' H ' ' A' ' 67' ' ' ASN . 30.5 mm -117.65 108.8 25.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.893 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -91.98 16.53 10.92 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.468 0.651 . . . . 0.0 110.004 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASN . . . . . 0.479 ' H ' HG22 ' A' ' 65' ' ' ILE . 95.2 m-20 -134.22 31.44 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.019 -176.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.658 HG21 HD13 ' A' ' 62' ' ' LEU . 1.7 m -86.45 44.13 1.12 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.378 0.609 . . . . 0.0 111.861 -171.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.57 -23.54 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.543 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -83.58 5.59 23.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.105 0.479 . . . . 0.0 111.074 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 97' ' ' TYR . 9.9 tt -97.52 115.82 28.55 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -100.18 -172.36 2.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.399 0.618 . . . . 0.0 111.354 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -96.82 141.52 29.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.19 168.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.45 31.27 28.04 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.818 176.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -119.08 -168.01 1.49 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.932 0.396 . . . . 0.0 110.419 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -138.38 134.59 34.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.7 pt -135.63 158.33 39.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 112.421 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -117.64 106.77 13.45 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.932 173.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 19.1 m -100.65 148.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.95 0.405 . . . . 0.0 111.866 -172.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.509 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 7.9 m-90 -106.23 104.92 14.72 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.331 173.381 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.513 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -107.21 159.08 16.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.057 -177.456 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -112.38 -30.97 6.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.771 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -134.57 127.17 30.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.973 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -119.25 123.61 44.69 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 174.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -125.1 121.03 33.09 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.621 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.79 83.6 7.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.939 0.4 . . . . 0.0 110.313 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -84.24 -13.77 51.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.833 175.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 66.2 t30 58.12 92.72 0.06 OUTLIER Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.151 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 15.0 Cg_exo -67.96 143.64 69.78 Favored 'Cis proline' 0 C--N 1.346 0.421 0 C-N-CA 123.836 -1.318 . . . . 0.0 112.768 2.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' A' ' 58' ' ' VAL . 31.7 Cg_exo -58.22 142.7 97.47 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.715 2.277 . . . . 0.0 112.327 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 15.5 m -122.82 156.63 34.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.637 179.185 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.533 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -146.47 136.36 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.558 0.218 . . . . 0.0 110.879 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.5 m -94.41 114.7 26.77 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.513 HG22 ' HB3' ' A' ' 81' ' ' PHE . 2.8 pp -104.11 142.0 18.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.782 -177.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -105.22 -9.56 17.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.753 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.27 147.6 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.461 ' CE2' HD12 ' A' ' 71' ' ' LEU . 4.7 p90 -134.07 146.67 50.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 0.0 110.703 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.509 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 33.2 tt0 -116.24 126.45 53.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.812 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 39.6 tp -75.97 135.92 40.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.31 0.576 . . . . 0.0 111.4 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 C--N 1.324 -0.539 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.502 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.511 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 76.7 mtm . . . . . 0 N--CA 1.451 -0.41 0 CA-C-O 120.678 0.275 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -88.56 139.11 30.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.577 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.6 t -88.88 124.5 34.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.963 0.411 . . . . 0.0 110.887 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.36 125.49 42.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.869 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 60.7 t -105.33 120.9 56.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 174.47 28.26 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.432 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -102.07 136.62 41.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.472 HG22 HD22 ' A' ' 30' ' ' LEU . 11.4 t -91.6 102.7 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.725 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.41 HG23 ' HG ' ' A' ' 22' ' ' LEU . 17.2 m -100.21 -35.58 4.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.499 -178.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.898 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 70.1 mt -129.72 138.52 51.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -176.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -148.73 127.92 12.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.8 175.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.26 -80.68 0.53 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.773 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -144.4 -66.57 0.34 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -89.94 -18.76 25.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.135 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -119.97 140.21 51.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.492 0.663 . . . . 0.0 112.048 -172.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.577 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.62 117.74 27.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.156 172.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.898 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 47.5 mt -88.63 105.91 16.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.752 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.472 HD22 HG22 ' A' ' 20' ' ' VAL . 20.8 mt -106.42 157.61 17.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.966 -176.163 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.9 mt -103.48 120.55 53.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -31.81 68.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.195 0.521 . . . . 0.0 110.787 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.54 130.31 35.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.194 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.2 p -75.94 79.06 2.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.421 0.629 . . . . 0.0 111.169 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -144.95 144.85 31.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.199 -176.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.74 119.58 69.46 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 50.1 Cg_exo -54.77 -71.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.906 2.404 . . . . 0.0 112.822 -175.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.43 166.72 14.51 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.433 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.07 -41.2 97.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.957 0.408 . . . . 0.0 110.358 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.69 -37.1 81.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.509 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.62 -34.82 77.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.389 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -73.84 -12.07 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.48 177.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -93.15 -23.82 18.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.023 0.44 . . . . 0.0 110.221 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.9 mt -70.51 152.9 43.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.882 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -71.62 155.78 40.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.201 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HG3' HD22 ' A' ' 22' ' ' LEU . 1.8 mp0 -51.14 -49.68 60.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.363 0.414 . . . . 0.0 111.118 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.09 81.39 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.936 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.43 -38.94 74.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.021 0.439 . . . . 0.0 110.232 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.69 -38.33 80.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.175 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.433 ' HE3' ' HG3' ' A' ' 89' ' ' PRO . 82.8 mtp -63.41 -33.48 75.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.634 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -70.11 -38.31 75.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.812 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.82 -52.25 18.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.857 -177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -96.1 37.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.837 0.351 . . . . 0.0 110.579 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -43.44 -49.51 7.14 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -172.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -108.58 8.38 27.11 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.22 16.22 13.16 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.838 0.351 . . . . 0.0 110.227 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.432 ' O ' ' HD2' ' A' ' 90' ' ' PRO . 8.0 tt -126.42 146.54 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.322 -174.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HB2' ' A' ' 90' ' ' PRO . 59.5 t -134.53 120.8 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.054 0.454 . . . . 0.0 110.446 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.1 mt -89.79 105.47 16.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.707 177.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 92' ' ' ALA . 33.8 m -87.25 146.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.354 0.597 . . . . 0.0 111.271 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -91.4 117.69 5.25 Favored Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.816 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 28' ' ' ALA . 85.9 mt -95.1 7.26 46.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.764 0.426 . . . . 0.0 110.009 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 p -57.75 -30.61 65.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.712 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -73.45 -35.17 65.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.494 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' 96' ' ' LYS . 36.1 mt -104.76 99.23 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.28 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.37 -21.01 63.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.538 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -97.57 37.43 1.37 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.514 0.674 . . . . 0.0 110.885 -176.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.528 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.0 OUTLIER -83.39 16.28 2.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.929 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -67.23 -20.48 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.201 0.524 . . . . 0.0 110.455 178.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.96 -21.09 65.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.628 178.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 77' ' ' ILE . 13.3 tp -76.91 144.49 38.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.318 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -132.5 -172.47 2.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.402 -174.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 73' ' ' ARG . 19.0 mtp180 -100.86 129.57 46.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 173.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.41 33.82 6.99 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.053 -0.594 . . . . 0.0 111.879 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.56 163.45 12.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.014 0.435 . . . . 0.0 111.296 -175.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -120.7 112.62 19.09 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 170.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 71' ' ' LEU . 42.0 pt -125.16 151.88 31.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.453 0.644 . . . . 0.0 111.899 -176.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.422 ' HE3' ' CH2' ' A' ' 80' ' ' TRP . 35.8 ttpt -107.99 107.42 18.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.881 175.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 34.3 m -100.25 157.98 3.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.016 0.436 . . . . 0.0 111.472 -174.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.511 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 11.0 m-90 -124.62 129.64 50.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.047 175.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 4.4 p90 -151.09 161.82 42.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.585 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -128.49 -35.67 1.93 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.1 m -93.88 106.24 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.649 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -103.87 133.31 49.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.396 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -112.69 93.87 4.64 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.534 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 43.2 tt0 -92.77 89.61 6.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.219 0.533 . . . . 0.0 110.218 -177.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -103.23 -3.65 25.41 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.267 -175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 63.43 97.3 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.435 0 O-C-N 123.755 0.66 . . . . 0.0 110.535 -175.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 57.1 Cg_endo -70.28 150.18 91.03 Favored 'Cis proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.533 -1.445 . . . . 0.0 112.897 1.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.534 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.0 Cg_exo -61.13 146.3 97.76 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.024 2.483 . . . . 0.0 112.633 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.7 m -132.29 157.92 43.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.929 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.44 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -147.2 122.27 10.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.602 0.239 . . . . 0.0 111.224 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.4 m -84.23 110.56 18.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.5 pt -101.24 141.52 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.264 -174.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HB2' ' SD ' ' A' ' 13' ' ' MET . 95.7 mt-30 -96.75 -21.29 17.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.627 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.54 ' HA ' HD11 ' A' ' 65' ' ' ILE . 57.8 tttm -158.31 146.02 18.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.539 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TYR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 24.8 p90 -128.0 174.71 8.96 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.497 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -143.59 118.71 10.1 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.4 tp -73.46 127.8 33.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.481 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.2 mt . . . . . 0 C--N 1.322 -0.616 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.71 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 71.2 mtp . . . . . 0 N--CA 1.453 -0.286 0 CA-C-O 120.517 0.198 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -100.63 125.49 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.619 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 60.0 p -92.52 149.56 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.283 0.564 . . . . 0.0 112.0 -174.485 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -146.74 131.47 17.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.181 175.507 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.4 t -98.18 126.32 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 158.79 27.8 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.416 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.411 ' HE1' ' HA ' ' A' ' 34' ' ' THR . 97.6 m-85 -84.8 124.2 31.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.434 ' HA ' HD22 ' A' ' 30' ' ' LEU . 15.0 t -81.68 107.95 14.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.502 HG11 ' HG2' ' A' ' 37' ' ' PRO . 27.1 m -114.99 -41.29 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.737 0.303 . . . . 0.0 111.665 -176.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.739 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 71.7 mt -120.94 144.72 48.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 68' ' ' THR . 48.4 tttm -148.36 132.04 16.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 0.0 111.65 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -111.82 -165.19 0.97 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 169.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -90.19 -25.92 20.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.426 0.631 . . . . 0.0 109.542 174.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -94.15 -32.48 13.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.645 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -143.9 161.48 38.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 0.0 111.048 -171.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.554 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.63 127.35 31.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.711 173.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.739 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 37.6 mt -93.83 111.21 24.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -177.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 20' ' ' VAL . 23.8 mt -112.42 148.96 33.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.689 -174.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.2 mt -98.49 119.29 46.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 174.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 p -85.76 -14.37 45.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.141 0.495 . . . . 0.0 110.793 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -75.7 163.15 27.59 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.411 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.5 p -89.48 -11.85 41.76 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -76.69 105.58 7.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 0.0 110.695 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.98 137.58 61.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.209 176.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HG2' HG11 ' A' ' 21' ' ' VAL . 24.1 Cg_exo -63.61 151.5 84.77 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.087 2.524 . . . . 0.0 112.62 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.98 -175.62 39.49 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.932 177.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -51.75 -53.34 40.76 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.831 0.453 . . . . 0.0 111.621 -178.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 4.2 mp0 -67.97 -26.82 66.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.342 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -69.89 -35.23 74.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.678 0.275 . . . . 0.0 110.775 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -72.37 -18.44 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.962 0.41 . . . . 0.0 110.526 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.05 -22.09 25.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 98.9 mt -63.9 151.53 42.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.4 p -75.23 163.13 27.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.976 0.417 . . . . 0.0 111.109 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' A' ' 50' ' ' MET . 41.2 tt0 -53.35 -45.64 69.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.319 -177.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.88 -47.0 93.41 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.577 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -61.57 -40.21 93.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.682 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.48 -43.27 97.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.389 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.409 ' HE3' ' HG2' ' A' ' 46' ' ' GLU . 66.0 mtt -66.64 -24.65 66.33 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.239 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -85.76 -35.91 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.274 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -73.04 -37.67 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.911 0.386 . . . . 0.0 110.652 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -107.68 39.2 1.97 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.229 0.538 . . . . 0.0 109.906 176.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -52.85 121.72 7.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.936 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.5 t30 73.84 -7.47 1.59 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.844 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.48 15.81 22.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.572 0.701 . . . . 0.0 110.106 178.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 21.0 tt -126.63 130.2 71.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.016 179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.507 HG22 ' HG2' ' A' ' 90' ' ' PRO . 95.2 t -115.44 128.83 72.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -172.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 91' ' ' SER . 57.4 mt -94.34 101.94 13.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.631 176.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.6 m -80.99 145.94 8.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.102 0.477 . . . . 0.0 110.639 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 114.54 4.32 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.308 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 28' ' ' ALA . 89.3 mt -98.76 13.74 31.22 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 177.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.0 t -61.48 -22.21 64.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.196 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -106.36 4.21 28.31 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.002 0.429 . . . . 0.0 110.709 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.8 mt -116.54 117.19 54.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.022 0.439 . . . . 0.0 110.608 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -92.14 -32.79 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 111.056 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -80.7 43.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.593 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . 0.521 ' O ' ' HE3' ' A' ' 23' ' ' LYS . 69.0 p -87.1 10.84 15.4 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 122.12 -0.363 . . . . 0.0 110.699 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.38 -36.09 60.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.849 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.37 -13.5 52.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.0 110.0 176.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.2 tp -79.28 100.74 7.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.654 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -106.22 148.12 28.29 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.598 -174.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.462 ' HD2' ' O ' ' A' ' 21' ' ' VAL . 15.4 ptt180 -91.52 152.35 20.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.906 0.384 . . . . 0.0 110.238 177.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.87 25.67 8.37 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -169.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.01 -164.44 2.02 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.972 0.415 . . . . 0.0 111.132 -173.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -131.47 141.55 49.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.243 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.8 pt -134.2 148.95 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.991 0.424 . . . . 0.0 110.945 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 50.0 tttp -103.31 106.83 17.44 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 175.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.1 m -97.17 147.09 6.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.498 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 16.0 m-90 -112.48 109.79 19.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.759 173.266 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.454 ' HB3' HG22 ' A' ' 94' ' ' ILE . 14.2 p90 -120.8 179.27 4.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -142.54 -38.72 0.36 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.36 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.5 m -110.41 121.72 45.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.68 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -108.87 132.97 53.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.24 0.543 . . . . 0.0 110.21 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -99.7 124.11 44.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.233 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -79.95 50.54 1.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.066 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -71.91 -29.29 64.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.585 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.4 t30 60.77 99.09 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 O-C-N 123.812 0.695 . . . . 0.0 111.268 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.83 153.31 79.86 Favored 'Cis proline' 0 C--N 1.344 0.341 0 C-N-CA 123.579 -1.425 . . . . 0.0 112.764 1.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' VAL . 12.5 Cg_endo -56.16 138.81 84.3 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.918 2.412 . . . . 0.0 112.536 -177.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 20.8 t -118.35 137.88 52.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.435 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -128.38 102.83 6.83 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.867 0.365 . . . . 0.0 111.077 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.9 m -68.99 112.23 5.49 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.467 HG21 ' HB ' ' A' ' 79' ' ' VAL . 34.4 pt -106.19 147.88 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.018 0.437 . . . . 0.0 111.022 -175.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -111.1 -25.29 9.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.44 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -142.16 137.56 30.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.251 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -140.03 153.6 46.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.92 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.469 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 40.8 tt0 -114.9 128.76 56.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.815 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.89 105.85 10.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.384 -178.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.0 mt . . . . . 0 C--N 1.325 -0.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtm . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -92.17 -25.82 18.51 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HE2' ' HB3' ' A' ' 3' ' ' LYS . 51.2 mtpt -84.94 88.93 7.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.417 172.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -62.42 135.41 57.42 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 176.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -45.97 125.59 6.48 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.677 0.611 . . . . 0.0 111.714 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.21 92.58 1.02 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -174.69 107.26 0.11 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.369 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 104.35 27.17 6.25 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.68 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -80.75 143.57 32.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.662 -0.269 . . . . 0.0 110.487 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.23 -52.16 17.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.062 0.458 . . . . 0.0 109.911 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.0 m -87.62 89.52 8.02 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.288 0.566 . . . . 0.0 110.056 176.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -75.5 104.64 6.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.175 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.6 mtp -87.62 147.66 25.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -83.73 115.16 22.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.029 0.442 . . . . 0.0 109.988 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.0 p -97.44 130.47 44.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.251 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -130.27 130.14 44.17 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.412 ' N ' HD13 ' A' ' 16' ' ' LEU . 50.8 t -95.54 123.51 47.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.22 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 176.61 27.29 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.706 -177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -101.24 134.84 43.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.66 0.267 . . . . 0.0 110.734 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 t -87.27 109.47 19.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.85 -36.76 4.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.103 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.737 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 89.6 mt -133.32 141.58 48.03 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -141.42 130.92 23.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.096 0.474 . . . . 0.0 111.624 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -115.83 -146.44 0.4 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 170.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -100.65 -55.73 2.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.029 0.377 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -90.46 -6.74 54.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.578 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -151.1 155.03 38.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.053 0.454 . . . . 0.0 111.437 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -141.72 149.5 40.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.085 176.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.737 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 70.4 mt -105.21 116.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.866 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 mt -118.78 151.91 37.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.282 0.563 . . . . 0.0 111.71 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -101.68 116.66 45.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.937 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.5 p -84.9 0.12 52.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.982 0.42 . . . . 0.0 111.301 -176.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -95.69 -172.22 2.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.496 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.4 p -106.16 -2.29 22.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -174.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -86.27 124.19 32.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.841 0.353 . . . . 0.0 110.367 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.34 145.65 34.45 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.812 176.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 16.7 Cg_exo -68.29 165.99 26.84 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.707 2.271 . . . . 0.0 112.44 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.4 176.61 37.09 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.19 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -51.62 -47.64 63.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 122.539 0.336 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.2 mt-10 -71.75 -26.24 62.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.532 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -67.1 -34.0 76.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.89 0.376 . . . . 0.0 110.201 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -74.27 -10.1 59.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.034 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -106.5 -5.11 19.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.877 0.37 . . . . 0.0 110.661 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 77.9 mt -74.54 163.78 27.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 48' ' ' GLN . 16.3 m -76.18 149.25 37.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 1.6 mp0 -49.48 -51.17 37.78 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.533 0.521 . . . . 0.0 111.321 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.82 -39.08 94.93 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.623 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' ' HB2' ' A' ' 45' ' ' SER . 83.2 mt-30 -64.75 -41.89 95.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.996 0.427 . . . . 0.0 110.291 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.98 -38.88 86.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.602 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.434 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 80.7 mtp -62.32 -40.86 97.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.189 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -72.66 -25.37 61.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 110.875 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -81.57 -54.46 5.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -92.71 23.88 3.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 0.0 110.528 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' ILE . 86.2 tttt -50.94 -28.8 10.53 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.518 -176.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -66.27 -31.59 72.5 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -143.57 28.86 1.43 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -173.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.463 HD11 ' CG2' ' A' ' 29' ' ' ILE . 15.1 tt -96.56 134.93 32.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.525 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.529 HG22 ' HG2' ' A' ' 90' ' ' PRO . 79.4 t -132.83 127.26 55.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.868 0.366 . . . . 0.0 110.354 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 63.9 mt -95.05 116.95 37.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 176.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 22.6 m -95.6 142.43 13.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.167 0.508 . . . . 0.0 111.68 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.15 114.39 4.2 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.431 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 28' ' ' ALA . 88.3 mt -96.59 9.87 40.22 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 122.61 0.364 . . . . 0.0 110.787 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.7 p -59.9 -31.15 69.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.074 0.464 . . . . 0.0 111.203 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.654 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 2.9 mm-40 -79.19 -19.46 50.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.293 -177.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.3 mt -103.55 113.37 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.584 -175.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -102.15 31.95 3.72 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.758 0.789 . . . . 0.0 110.618 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -145.3 37.72 1.13 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.3 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.474 HG21 ' HB3' ' A' ' 62' ' ' LEU . 40.7 p -69.86 5.01 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.04 -15.58 58.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.631 0.253 . . . . 0.0 111.287 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -89.3 -4.67 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.08 0.466 . . . . 0.0 109.944 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 tp -81.68 116.49 21.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.979 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -99.51 130.4 45.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.727 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.4 ptt85 -90.23 142.47 27.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.8 19.06 45.2 Favored Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 -171.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 6.1 mm-40 -134.67 -167.97 2.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.595 -171.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 88.3 tttt -127.76 138.77 52.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.924 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.523 HG22 HD12 ' A' ' 99' ' ' LEU . 38.3 pt -139.81 168.03 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 121.505 0.669 . . . . 0.0 112.233 -178.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -123.93 106.88 10.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.829 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.0 m -101.6 147.51 8.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -173.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.581 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 6.0 m-90 -110.22 115.4 29.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.815 173.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 44.2 p90 -127.94 172.34 10.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 0.0 111.008 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -155.95 -50.02 0.08 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.995 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 m -84.83 119.89 25.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.542 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 84' ' ' ARG . 13.9 ptt180 -139.13 153.03 47.92 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.938 0.399 . . . . 0.0 111.045 -176.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -120.64 106.43 11.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.71 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -86.96 97.94 10.98 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.14 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.8 m -112.27 -14.16 13.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.856 -175.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 60.73 93.59 0.06 OUTLIER Pre-proline 0 N--CA 1.467 0.411 0 O-C-N 123.479 0.487 . . . . 0.0 110.71 -172.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.45 ' HB3' HG23 ' A' ' 57' ' ' ILE . 14.7 Cg_exo -69.87 146.95 83.82 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.797 -1.335 . . . . 0.0 112.299 -1.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.529 ' HG2' HG22 ' A' ' 58' ' ' VAL . 62.0 Cg_endo -74.07 155.95 47.38 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.626 2.217 . . . . 0.0 112.783 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.6 p -128.02 145.05 51.11 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.712 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -129.95 128.54 42.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.681 0.277 . . . . 0.0 111.008 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.3 m -87.29 113.71 23.25 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 29.3 pt -108.29 129.44 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.059 0.457 . . . . 0.0 110.7 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.654 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 82.9 mt-30 -101.33 -9.43 21.18 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.664 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 51.6 tttm -158.72 140.98 14.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.3 165.76 26.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.872 0.367 . . . . 0.0 111.047 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -125.11 117.24 23.48 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.523 HD12 HG22 ' A' ' 77' ' ' ILE . 37.1 tp -70.64 137.99 50.37 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.375 -177.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 90.8 mt -112.45 -174.23 2.41 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.0 tp -153.18 148.0 26.4 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -176.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.67 -36.91 83.66 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.385 0.612 . . . . 0.0 110.183 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 51.4 t60 -72.8 -45.62 57.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.25 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -142.79 125.79 16.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.61 0.243 . . . . 0.0 110.509 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -80.84 -43.65 19.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.467 -175.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.4 87.42 0.63 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.904 0.383 . . . . 0.0 110.187 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -62.62 137.95 58.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.313 -173.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 40.9 m80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.465 -0.779 . . . . 0.0 109.464 178.458 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.729 0.299 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.2 t-20 -116.86 75.45 0.97 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -113.46 98.85 7.34 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.51 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -73.39 114.64 11.83 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.33 -45.98 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.555 -173.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 53.55 36.46 23.43 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.629 0.58 . . . . 0.0 110.562 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.33 129.3 46.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.67 -174.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.58 -142.03 7.34 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.995 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -70.68 -27.97 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.91 0.386 . . . . 0.0 110.946 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.11 -36.48 77.55 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.17 175.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.3 55.49 2.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.0 tttp -136.45 109.72 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 110.282 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 61.9 mtm -102.7 152.14 21.56 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -177.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -85.42 120.08 26.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.14 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.409 ' HG ' ' HE1' ' A' ' 80' ' ' TRP . 7.9 m -96.44 128.45 43.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.502 -174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.441 HD12 ' CE1' ' A' ' 81' ' ' PHE . 11.6 mt -130.21 160.02 35.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.788 173.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -127.57 126.93 68.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.58 166.69 29.19 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.797 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -104.76 132.89 50.46 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.745 0.307 . . . . 0.0 110.285 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.534 HG21 HD11 ' A' ' 71' ' ' LEU . 12.0 t -89.15 100.65 11.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 m -92.12 -40.43 12.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.53 -177.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 99.0 mt -127.78 141.14 51.66 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.916 -178.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -126.39 136.25 52.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.759 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.718 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 7.7 t70 -135.92 -167.15 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -79.49 106.96 11.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -176.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 71.41 7.99 6.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.324 0.65 . . . . 0.0 111.841 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.718 ' HG3' ' HB3' ' A' ' 24' ' ' ASP . 32.9 ptt180 -146.46 140.21 26.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.798 0.332 . . . . 0.0 110.398 -176.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.5 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -128.65 142.57 50.99 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.435 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 60.4 mt -97.68 107.07 19.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD11 HG22 ' A' ' 20' ' ' VAL . 4.0 mm? -102.15 147.28 26.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.959 -176.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.435 ' HA ' ' O ' ' A' ' 56' ' ' ASN . 20.0 mt -106.31 123.71 61.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.076 173.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.5 p -81.71 -7.97 59.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.54 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.21 156.22 38.77 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 175.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.2 p -100.04 12.8 36.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -168.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -125.81 144.11 50.78 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 171.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.9 137.82 79.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 173.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.54 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 56.4 Cg_endo -69.99 177.38 5.79 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.474 2.116 . . . . 0.0 112.318 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.19 169.72 54.09 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.531 -0.843 . . . . 0.0 111.753 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -66.31 -27.01 67.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 37.4 mp0 -62.6 -42.49 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.376 176.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 14.2 m-20 -67.0 -35.27 79.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.433 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -69.6 -23.48 63.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.91 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.29 -15.37 38.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.423 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.7 mt -71.48 173.11 8.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.459 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.8 m -103.04 177.42 4.84 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.49 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.62 -47.54 81.91 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.073 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -33.15 72.39 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.635 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.5 ' HB3' HD13 ' A' ' 44' ' ' LEU . 78.8 mm-40 -65.07 -51.84 59.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.771 0.32 . . . . 0.0 110.63 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.3 mt -67.6 -31.38 71.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.491 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.613 ' HG3' ' HG3' ' A' ' 89' ' ' PRO . 47.9 ttm -63.01 -33.61 75.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.229 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -87.31 -44.62 11.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.224 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -69.82 -54.47 13.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.358 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.445 ' O ' HG22 ' A' ' 57' ' ' ILE . 99.4 m-85 -99.03 46.09 0.99 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tttp -52.15 -35.4 48.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.768 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -111.67 14.45 21.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.823 0.344 . . . . 0.0 111.425 -177.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 31' ' ' ILE . 18.6 m120 -122.88 -4.52 8.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.811 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.445 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.2 tt -97.47 116.36 39.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.531 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.516 HG22 ' HB2' ' A' ' 90' ' ' PRO . 88.4 t -120.88 116.28 49.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.362 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.551 HG12 HG12 ' A' ' 29' ' ' ILE . 59.9 mt -85.32 104.72 13.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 92' ' ' ALA . 34.9 m -93.92 141.29 15.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.167 0.508 . . . . 0.0 111.421 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.37 130.62 9.82 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.589 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 68' ' ' THR . 41.2 mt -105.61 7.74 32.89 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 124.177 0.575 . . . . 0.0 110.189 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.6 m -59.74 -28.56 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -172.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -95.07 -14.03 24.63 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.559 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 55.9 mt -107.34 104.28 16.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.73 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -77.53 -23.12 50.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.118 -177.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -85.55 41.04 0.87 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.222 0.534 . . . . 0.0 111.089 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.537 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.8 p -96.07 15.19 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.896 177.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -41.9 93.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.13 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.81 1.73 37.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.17 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.534 HD11 HG21 ' A' ' 20' ' ' VAL . 42.7 tp -77.11 121.18 23.23 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 30.4 mttp -120.69 -172.46 2.38 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.457 -175.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 73' ' ' ARG . 52.2 mtt180 -98.05 134.56 40.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 173.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 88.26 26.39 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 72' ' ' LYS . 9.8 mm-40 -103.5 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.016 0.436 . . . . 0.0 110.51 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -132.14 127.77 36.65 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 176.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.473 HG22 ' HA ' ' A' ' 99' ' ' LEU . 37.4 pt -137.25 155.01 31.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.426 0.631 . . . . 0.0 112.037 -176.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.458 ' HB2' HD11 ' A' ' 100' ' ' LEU . 86.0 tttt -106.95 114.8 29.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.574 173.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 22.6 m -104.56 139.5 25.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 0.0 111.944 -173.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.409 ' HE1' ' HG ' ' A' ' 15' ' ' SER . 4.8 m-90 -109.4 122.82 48.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.118 170.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.441 ' CE1' HD12 ' A' ' 16' ' ' LEU . 2.0 p90 -149.06 177.13 9.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.073 0.463 . . . . 0.0 110.912 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -144.79 -42.01 0.24 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.3 m -82.5 104.76 13.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.163 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -98.76 117.35 33.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -99.2 115.39 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.543 . . . . 0.0 110.523 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.23 90.97 4.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.259 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -98.29 -31.11 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.873 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.83 90.46 0.08 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 124.015 0.822 . . . . 0.0 110.715 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.613 ' HG3' ' HG3' ' A' ' 50' ' ' MET . 36.7 Cg_endo -62.37 151.4 63.99 Favored 'Cis proline' 0 C--N 1.354 0.842 0 C-N-CA 124.762 -0.932 . . . . 0.0 114.16 7.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.516 ' HB2' HG22 ' A' ' 58' ' ' VAL . 51.6 Cg_exo -54.35 144.03 62.81 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.602 2.868 . . . . 0.0 113.911 -174.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.1 t -130.48 164.31 25.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.579 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.414 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.25 170.43 22.28 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.697 0.284 . . . . 0.0 110.484 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -126.66 117.32 22.51 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 27.0 pt -89.46 141.82 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.439 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -95.46 -35.07 11.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.908 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -158.75 149.19 19.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.398 175.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' OH ' ' HA ' ' A' ' 68' ' ' THR . 13.2 p90 -138.93 143.71 38.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.257 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -114.68 129.41 56.68 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.359 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.473 ' HA ' HG22 ' A' ' 77' ' ' ILE . 57.3 tp -76.17 122.47 24.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.621 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 78' ' ' LYS . 87.3 mt -112.11 84.09 1.91 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.426 ' HG ' ' H ' ' A' ' 103' ' ' HIS . 42.3 tp -82.98 155.88 23.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.32 -177.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -59.22 -26.33 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.255 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.426 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 24.8 m80 -114.79 139.68 49.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.164 177.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -78.79 -31.43 46.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.915 -176.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -115.66 159.18 21.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.082 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -67.46 -42.53 82.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.523 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -135.11 -174.29 3.57 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 0.0 110.768 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.067 -177.179 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.524 0.202 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.4 t30 60.14 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -166.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.558 ' HE3' ' O ' ' A' ' 6' ' ' GLN . 57.3 tttp -92.92 105.57 17.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.985 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -67.49 117.43 9.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.567 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 64.29 -163.18 0.27 Allowed 'General case' 0 C--O 1.233 0.2 0 O-C-N 123.666 0.604 . . . . 0.0 109.805 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.558 ' O ' ' HE3' ' A' ' 3' ' ' LYS . 50.1 tt0 -103.47 -43.32 5.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.088 0.47 . . . . 0.0 109.968 177.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -123.75 111.69 16.45 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.202 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -78.91 178.28 53.59 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.335 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -90.36 143.68 26.53 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -78.53 -29.29 46.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.628 -178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.2 m -70.77 115.83 10.37 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.393 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -85.61 143.07 28.66 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.532 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.549 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 65.8 mtm -80.27 140.01 36.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.882 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -85.43 116.74 23.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 110.17 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.4 m -84.9 125.63 32.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.227 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.461 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 3.0 tm? -116.67 120.2 37.88 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.5 t -98.51 123.71 51.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.143 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.36 169.59 34.37 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.854 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -105.55 140.9 37.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.246 0.218 . . . . 0.0 110.52 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.562 HG21 HD11 ' A' ' 71' ' ' LEU . 22.6 t -87.76 113.92 25.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.64 -41.33 4.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.192 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 95.7 mt -134.02 160.17 38.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.814 0.34 . . . . 0.0 110.416 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -148.43 162.3 39.87 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.826 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -156.68 -164.68 1.7 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -75.81 -47.74 24.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 111.336 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -82.37 -45.89 14.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.861 -176.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.684 ' HG2' ' HA2' ' A' ' 61' ' ' GLY . 33.1 mtm180 -138.71 163.3 32.5 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.569 -169.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -116.12 152.49 33.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.314 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 58.6 mt -109.32 113.99 45.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.075 0.464 . . . . 0.0 110.787 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.53 HD13 HD11 ' A' ' 77' ' ' ILE . 66.9 mt -113.78 144.16 43.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.934 -176.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.3 mt -102.9 120.66 53.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -85.26 -7.58 58.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.095 0.474 . . . . 0.0 111.1 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 10.2 t70 -89.79 158.93 17.28 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.645 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.7 p -97.6 2.6 50.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -81.82 110.37 17.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 173.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.49 131.84 70.56 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.206 -175.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.35 160.39 47.94 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.845 2.363 . . . . 0.0 112.032 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.54 179.58 35.99 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.144 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 7.9 tmtm? -57.94 -41.42 82.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.851 0.358 . . . . 0.0 110.542 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.03 -27.51 64.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.235 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.08 -33.93 76.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.93 0.395 . . . . 0.0 109.967 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.45 -14.23 61.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -89.29 -22.18 22.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.009 0.433 . . . . 0.0 109.956 175.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -69.73 153.07 43.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.665 178.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.9 p -82.93 165.66 19.54 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.151 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 50' ' ' MET . 36.2 mp0 -48.72 -50.98 31.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.709 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.13 -48.99 83.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.748 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -64.02 -32.26 73.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.636 0.255 . . . . 0.0 111.142 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.8 tp -67.34 -41.85 84.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.534 ' HG2' HD13 ' A' ' 57' ' ' ILE . 65.0 mtt -65.7 -32.01 73.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -66.43 -36.03 81.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.867 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -82.81 -54.49 5.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.135 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.32 41.34 1.06 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.343 0.592 . . . . 0.0 110.238 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 77.9 tttt -60.79 124.99 22.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.607 -177.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 4.5 m-20 72.99 4.86 5.08 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.917 0.761 . . . . 0.0 111.256 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.518 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 88.7 m-20 -118.63 11.91 12.96 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.534 HD13 ' HG2' ' A' ' 50' ' ' MET . 13.2 tt -129.06 134.2 64.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.196 -176.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 82.1 t -124.38 132.72 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.459 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 91' ' ' SER . 29.8 mt -98.94 104.9 16.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.645 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.9 m -94.21 128.87 45.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.32 0.581 . . . . 0.0 111.297 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 27' ' ' ARG . . . -80.33 122.06 5.63 Favored Glycine 0 N--CA 1.443 -0.893 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.669 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.42 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.7 mt -88.43 31.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.131 0.491 . . . . 0.0 110.061 -178.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.4 m -63.69 -26.17 68.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.632 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 64' ' ' GLU . 3.6 tp10 -105.26 -3.08 23.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.401 0.619 . . . . 0.0 110.081 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.7 mm -122.62 91.05 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.997 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -98.21 18.09 17.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 122.08 0.943 . . . . 0.0 109.913 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -121.15 14.39 11.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.493 -173.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 32.52 0.26 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -171.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -89.49 -14.66 34.8 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.363 0.601 . . . . 0.0 109.717 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -81.8 -28.52 33.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.451 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.562 HD11 HG21 ' A' ' 20' ' ' VAL . 12.6 tp -57.36 123.29 14.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.806 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -104.73 170.74 7.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 111.165 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.8 mtt85 -87.22 143.3 27.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.24 -0.437 . . . . 0.0 109.979 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.58 42.0 18.74 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -124.28 -174.88 3.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.221 0.534 . . . . 0.0 112.017 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.493 ' H ' ' HE1' ' A' ' 105' ' ' HIS . 56.7 tttm -135.2 125.2 25.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.712 -175.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.63 HD13 HG13 ' A' ' 79' ' ' VAL . 2.6 pp -135.6 171.47 17.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.488 0.661 . . . . 0.0 112.708 -174.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -135.15 111.73 9.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.697 174.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.63 HG13 HD13 ' A' ' 77' ' ' ILE . 27.8 m -107.29 156.02 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.816 0.341 . . . . 0.0 111.208 -176.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 9.8 m-90 -122.69 130.59 53.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.838 175.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 94' ' ' ILE . 44.5 p90 -148.33 -178.34 6.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.034 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -140.99 -45.06 0.39 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.02 175.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.3 m -82.94 117.76 23.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 49.9 ptt85 -139.61 155.04 47.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.758 0.313 . . . . 0.0 110.58 176.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -122.34 128.98 51.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.372 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.52 59.49 4.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.42 0.628 . . . . 0.0 110.139 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -79.12 -22.27 45.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.697 177.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 68.69 102.06 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.811 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.481 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 16.3 Cg_exo -69.0 146.8 81.63 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.829 -1.321 . . . . 0.0 112.194 -0.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 29.9 Cg_exo -61.26 137.56 71.5 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.837 2.358 . . . . 0.0 112.624 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 14.6 m -115.93 145.97 42.47 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.146 176.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -147.41 128.95 15.02 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.588 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 46.7 m -83.41 112.77 20.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.569 ' HA ' ' HB3' ' A' ' 81' ' ' PHE . 40.9 pt -87.04 149.85 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.105 0.479 . . . . 0.0 111.287 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -103.65 -48.09 4.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.32 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -138.48 163.97 30.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.05 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.524 ' HB2' HG12 ' A' ' 79' ' ' VAL . 6.2 p90 -164.23 159.06 19.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.665 0.269 . . . . 0.0 110.725 177.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -121.01 132.75 55.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.711 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 77' ' ' ILE . 38.4 tp -82.1 108.98 16.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.963 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.96 94.38 9.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.406 0.622 . . . . 0.0 109.858 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 23.2 tp -81.92 89.16 6.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.639 -175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.566 ' HB2' ' CD2' ' A' ' 105' ' ' HIS . 37.1 mt-10 -63.61 163.76 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.37 177.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -64.96 -28.42 69.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 169.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -54.91 -32.51 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.79 172.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' HIS . . . . . 0.644 ' HA ' ' CE1' ' A' ' 108' ' ' HIS . 14.0 m170 -81.88 -8.21 59.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.707 -172.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -76.87 -25.15 52.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.17 -177.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -146.06 99.32 3.23 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.644 ' CE1' ' HA ' ' A' ' 105' ' ' HIS . 28.2 p-80 . . . . . 0 C--O 1.249 1.027 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.437 ' HB3' ' H ' ' A' ' 2' ' ' ASN . 80.8 mmm . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 120.527 0.203 . . . . 0.0 110.865 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.437 ' H ' ' HB3' ' A' ' 1' ' ' MET . 21.1 p-10 -74.81 14.35 0.52 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -170.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.785 ' HB2' ' HG3' ' A' ' 5' ' ' GLU . 93.4 mttt -98.7 4.03 47.79 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 173.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 62.31 36.51 14.54 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.417 0.627 . . . . 0.0 109.918 -175.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.785 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 12.9 mt-10 -70.93 147.68 48.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.892 -1.049 . . . . 0.0 112.199 -173.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.25 -43.22 21.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.209 172.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -110.03 138.83 45.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.373 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 153.16 -57.48 0.42 Allowed Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.595 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -99.28 -87.35 0.36 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.498 0.189 . . . . 0.0 111.499 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 61.89 11.09 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.123 0.569 . . . . 0.0 111.621 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.5 p -88.36 131.34 34.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.328 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.9 126.5 30.59 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 110.295 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.43 ' SD ' ' HD2' ' A' ' 96' ' ' LYS . 83.2 mtp -119.89 156.25 31.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.813 -179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -83.26 121.81 27.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.762 0.315 . . . . 0.0 110.4 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 m -82.74 125.36 31.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.074 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.487 ' O ' HG22 ' A' ' 79' ' ' VAL . 2.7 tm? -138.72 120.59 15.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -89.97 139.16 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -149.61 145.5 13.75 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.18 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.864 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 87.5 m-85 -91.61 121.14 33.01 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.443 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 40.0 t -75.82 93.57 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.48 -38.13 7.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.094 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.793 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 93.2 mt -121.91 124.75 44.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.155 0.503 . . . . 0.0 110.19 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -124.61 119.05 27.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.936 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -118.47 13.61 13.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.121 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 75.08 -55.08 0.65 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.922 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -85.24 -36.77 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 27' ' ' ARG . 43.1 mtp180 -113.39 148.36 35.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.759 176.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.569 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -138.69 130.81 28.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.02 0.438 . . . . 0.0 110.62 175.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 66.8 mt -104.34 115.78 46.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.443 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.4 mt -114.47 147.18 39.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.125 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.89 129.12 53.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 168.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.5 p -53.93 -58.61 6.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.77 0.319 . . . . 0.0 111.005 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.864 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 35.4 t70 -164.71 140.4 5.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.52 0.676 . . . . 0.0 111.952 174.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.3 m -146.97 17.11 1.23 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm 48.25 64.02 1.83 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.975 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.412 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 61.58 96.43 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.994 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 24.7 Cg_endo -62.73 167.73 11.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.774 2.316 . . . . 0.0 111.998 178.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -92.18 167.0 30.01 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.978 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -62.97 -28.97 70.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.224 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 39.4 tt0 -66.06 -33.58 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.547 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.86 -34.03 73.05 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -73.87 -19.24 60.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.868 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -78.69 -30.92 46.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.357 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.8 mt -63.3 142.91 58.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.351 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.2 m -76.0 168.91 19.17 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.404 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.53 -49.55 45.62 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.495 0.497 . . . . 0.0 111.537 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.6 -45.62 95.99 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.22 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.73 -41.49 92.18 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.969 0.414 . . . . 0.0 110.675 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.13 -43.52 98.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.165 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 45.9 ttm -67.21 -34.35 77.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.342 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -71.7 -24.65 61.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.709 0.29 . . . . 0.0 111.245 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.88 -54.84 3.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.951 0.405 . . . . 0.0 110.777 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -97.4 40.17 1.17 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.639 -177.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -54.84 -34.99 63.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.417 -173.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -92.37 -5.34 52.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.678 0.275 . . . . 0.0 111.422 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -121.48 3.17 10.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.6 tt -96.28 121.91 47.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.327 0.584 . . . . 0.0 110.834 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.8 t -124.48 121.98 62.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.075 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 91' ' ' SER . 60.3 mt -91.76 105.85 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 34.1 m -98.75 150.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.264 0.554 . . . . 0.0 111.296 -175.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.53 126.58 8.68 Favored Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.841 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.577 ' HB3' HG21 ' A' ' 68' ' ' THR . 85.4 mt -100.72 19.0 17.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.182 0.515 . . . . 0.0 109.853 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.1 m -61.27 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.583 -176.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.65 -51.47 11.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.281 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 49.1 mt -89.28 108.68 19.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.469 -176.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.22 12.13 19.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.824 0.345 . . . . 0.0 111.227 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -112.89 34.52 4.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.304 0.573 . . . . 0.0 109.572 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 62' ' ' LEU . 5.8 p -89.3 2.53 54.21 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -80.22 -11.32 59.75 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.944 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.37 -25.03 63.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.295 172.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.26 158.61 28.51 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.536 174.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -142.86 154.45 44.15 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.722 178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.51 118.07 14.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.155 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 106.2 22.69 7.73 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.136 -0.785 . . . . 0.0 111.136 -175.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -113.48 165.08 12.82 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -127.42 124.39 38.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.922 0.392 . . . . 0.0 110.554 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 99' ' ' LEU . 39.5 pt -130.24 153.14 38.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.782 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE3' ' CZ2' ' A' ' 80' ' ' TRP . 35.9 ttpt -111.8 110.66 21.14 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' A' ' 97' ' ' TYR . 8.6 m -99.6 159.23 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 111.869 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 20.9 m-90 -127.77 128.41 45.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.467 173.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -134.83 175.17 9.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.155 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -95.81 -37.75 10.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.161 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.1 t -154.71 157.19 37.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.535 ' HA ' ' HB2' ' A' ' 92' ' ' ALA . 50.7 ttp180 -121.39 134.92 55.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -88.11 125.26 34.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.951 0.405 . . . . 0.0 110.376 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -80.83 74.52 7.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.209 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -86.68 -24.3 25.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.899 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 33.4 t30 61.09 92.17 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.685 -174.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.44 156.75 96.76 Favored 'Cis proline' 0 C--N 1.345 0.355 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.392 -0.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.11 139.88 92.56 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.863 2.375 . . . . 0.0 112.662 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 18.1 p -135.31 142.75 45.89 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HA ' ' A' ' 84' ' ' ARG . . . -158.28 139.06 12.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.706 0.289 . . . . 0.0 111.19 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -81.17 115.77 20.75 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.4 pt -86.31 135.83 24.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.123 0.487 . . . . 0.0 110.488 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -106.05 -22.89 12.77 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.979 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' HD2' ' SD ' ' A' ' 13' ' ' MET . 65.2 mttp -142.88 147.34 35.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.915 177.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -152.81 156.77 39.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.987 0.423 . . . . 0.0 110.677 171.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -114.84 112.0 22.09 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.565 ' HA ' HG22 ' A' ' 77' ' ' ILE . 6.1 tt -72.31 113.31 9.21 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.9 mt -69.31 118.18 11.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.201 -172.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.92 96.59 0.06 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.23 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -59.08 125.7 24.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.512 176.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -57.32 -47.92 80.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.126 -176.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 11.8 m170 57.68 81.13 0.15 Allowed 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -87.15 -16.25 35.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -93.82 100.96 13.05 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 160.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -95.62 114.63 26.4 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 15.8 p80 . . . . . 0 C--O 1.241 0.647 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.327 168.079 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttp . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 111.293 0.109 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.7 t30 -134.01 -14.72 2.35 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB2' ' OE2' ' A' ' 5' ' ' GLU . 99.4 mttt -92.44 8.63 37.81 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.967 -0.458 . . . . 0.0 111.178 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.79 75.83 0.36 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.201 0.524 . . . . 0.0 109.72 -174.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 3' ' ' LYS . 60.1 mp0 -87.46 -46.83 9.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.447 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -87.21 111.04 20.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.074 0.464 . . . . 0.0 110.624 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -137.54 173.13 12.0 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.785 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.1 2.64 51.59 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.545 -178.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -130.1 110.22 11.44 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -126.62 -41.44 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.65 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 15.9 m -65.03 96.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.529 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -115.53 107.2 14.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.339 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.505 ' HE1' ' HB2' ' A' ' 95' ' ' GLN . 75.4 mtp -86.21 172.0 10.85 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 85.1 mm-40 -83.76 115.19 22.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.089 0.471 . . . . 0.0 109.865 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.6 t -96.93 129.9 44.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.222 -172.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.9 137.37 29.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.7 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 62.1 t -97.68 137.76 24.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 32' ' ' THR . . . -148.62 154.5 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.432 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.7 127.14 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.436 ' HA ' HD22 ' A' ' 30' ' ' LEU . 10.9 t -83.02 102.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 p -120.51 -49.41 3.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.608 ' HB3' ' HB ' ' A' ' 29' ' ' ILE . 25.8 tp -122.7 138.76 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.773 0.32 . . . . 0.0 110.855 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -131.06 162.87 28.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.869 0.366 . . . . 0.0 110.781 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -123.05 -69.87 0.8 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.351 171.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -166.09 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.936 176.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -93.8 -15.43 25.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.243 0.544 . . . . 0.0 110.268 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 27' ' ' ARG . 14.6 ptt180 -116.49 141.37 48.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.811 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.41 145.94 47.4 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.425 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' A' ' 22' ' ' LEU . 66.6 mt -107.33 108.17 24.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.963 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 20' ' ' VAL . 58.8 mt -116.06 149.8 38.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.981 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.467 HD12 ' HG3' ' A' ' 37' ' ' PRO . 54.6 mt -109.26 122.05 63.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.402 ' HA ' ' HA2' ' A' ' 18' ' ' GLY . 23.9 p -94.3 7.56 44.96 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 34' ' ' THR . 31.9 t70 -163.58 -162.73 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.581 ' HG1' ' HE1' ' A' ' 53' ' ' PHE . 6.5 m 82.15 23.07 0.23 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.686 0.795 . . . . 0.0 111.854 175.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.0 tttm 56.8 42.52 26.5 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.414 169.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.63 134.36 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.543 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.467 ' HG3' HD12 ' A' ' 31' ' ' ILE . 45.1 Cg_exo -56.25 136.58 76.07 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.826 2.351 . . . . 0.0 112.107 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.63 -163.34 30.3 Favored Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.713 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -52.64 -58.29 7.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.859 0.464 . . . . 0.0 111.89 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -68.34 -27.29 66.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.754 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -67.76 -30.55 70.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.83 0.348 . . . . 0.0 110.648 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -83.49 -1.77 54.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.845 0.355 . . . . 0.0 111.06 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -110.6 -10.97 14.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 93.1 mt -79.6 149.15 31.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.031 0.443 . . . . 0.0 111.248 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.7 m -88.77 -178.93 5.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.242 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -55.2 -60.84 2.83 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.03 -33.97 86.1 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.569 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -71.49 -37.26 71.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.362 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.97 -42.77 94.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.566 176.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 80.4 mtp -66.77 -23.64 66.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.922 177.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -74.95 -42.24 58.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.856 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -77.17 -45.71 25.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 110.668 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.581 ' HE1' ' HG1' ' A' ' 34' ' ' THR . 89.2 m-85 -98.81 44.65 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -175.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -44.09 -39.2 4.07 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -121.29 9.81 10.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -176.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -120.22 -5.45 9.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.8 tt -99.37 132.06 45.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.928 0.394 . . . . 0.0 109.955 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 63.5 t -122.97 126.97 74.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.945 0.403 . . . . 0.0 110.617 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.6 mt -96.72 100.91 11.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.6 m -89.1 141.99 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.124 0.488 . . . . 0.0 111.374 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.77 115.33 4.63 Favored Glycine 0 N--CA 1.441 -0.996 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.18 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.4 mt -94.47 27.09 3.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 0.0 110.123 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.5 m -55.57 -35.84 66.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.89 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 14.8 mm-40 -81.87 -6.91 59.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 111.092 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -114.32 99.91 9.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -68.45 -41.06 80.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.414 -174.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -107.01 106.75 17.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.929 0.395 . . . . 0.0 110.737 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -98.3 18.58 16.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.425 0.631 . . . . 0.0 109.517 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.39 -29.83 70.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.304 -171.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -81.28 -17.81 48.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt -71.5 125.06 26.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.908 0.385 . . . . 0.0 110.568 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -106.68 -172.59 2.11 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.878 -176.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 73' ' ' ARG . 15.8 ttt180 -111.36 126.01 54.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 177.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 33.65 5.36 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.781 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.09 179.58 3.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 111.103 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.484 ' HD2' ' HG2' ' A' ' 102' ' ' GLU . 48.9 mttp -129.44 129.6 44.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.397 176.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 99' ' ' LEU . 30.1 pt -130.84 145.13 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.019 0.438 . . . . 0.0 111.275 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.564 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 8.1 ttpm? -106.34 107.27 18.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.2 m -98.24 154.25 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.019 0.438 . . . . 0.0 111.711 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.564 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 23.2 m-90 -121.34 115.45 22.97 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.132 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.538 ' HB3' HG22 ' A' ' 94' ' ' ILE . 5.5 p90 -118.01 166.83 12.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.556 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -126.97 -25.61 3.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.357 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.8 m -117.86 111.61 19.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.937 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.7 mtm180 -108.45 140.1 42.25 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.035 172.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -121.59 110.23 15.74 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -79.25 87.6 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.985 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.4 p -102.15 -26.78 13.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.207 177.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.5 m120 57.98 90.96 0.08 OUTLIER Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.348 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.425 ' HB3' HG23 ' A' ' 57' ' ' ILE . 46.3 Cg_endo -67.82 136.04 32.19 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.81 1.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.75 153.31 29.69 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.61 2.207 . . . . 0.0 113.039 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -116.01 153.64 31.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.336 176.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -148.08 132.82 17.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.743 0.306 . . . . 0.0 110.758 -179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.9 m -90.71 116.22 28.41 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.936 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.538 HG22 ' HB3' ' A' ' 81' ' ' PHE . 46.8 pt -101.66 148.59 7.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.946 0.403 . . . . 0.0 110.725 -178.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.505 ' HB2' ' HE1' ' A' ' 13' ' ' MET . 97.0 mt-30 -111.44 -28.2 8.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.36 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -136.94 152.83 50.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.725 -179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -154.56 144.95 22.1 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -114.55 118.26 33.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.047 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.57 ' HA ' HG22 ' A' ' 77' ' ' ILE . 3.0 tt -77.62 111.11 13.04 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.78 111.76 13.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.426 -175.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 106' ' ' HIS . 41.1 tp -82.58 83.29 7.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.253 0.549 . . . . 0.0 110.141 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.484 ' HG2' ' HD2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -87.55 -19.87 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.163 178.341 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -74.44 88.48 2.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 18.1 m80 -55.79 -44.42 77.74 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -163.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -80.18 60.74 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.034 -0.666 . . . . 0.0 111.548 -171.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' HIS . . . . . 0.531 ' HB2' HD21 ' A' ' 101' ' ' LEU . 63.8 m80 -137.27 9.27 2.95 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.205 172.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -118.36 -76.65 0.57 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.378 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 68.8 t60 . . . . . 0 C--O 1.245 0.824 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.492 176.654 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.7 mtt . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -136.29 20.04 3.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -75.43 -29.32 59.69 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.335 176.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 65.5 t30 64.35 33.86 11.03 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.605 0.717 . . . . 0.0 110.378 176.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -24.35 66.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.853 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -78.07 14.81 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.441 -176.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -78.34 -14.87 59.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.232 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -62.37 -23.61 64.72 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.971 -0.558 . . . . 0.0 113.231 -177.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.25 -47.99 74.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 110.886 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -82.7 -45.81 13.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.256 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.2 m -90.98 95.52 10.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.688 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.56 106.66 4.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.44 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.0 mtm -86.23 158.87 19.62 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.109 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -83.78 125.45 31.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.981 0.42 . . . . 0.0 110.474 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.0 m -85.24 124.72 32.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.539 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.488 HD11 ' HA ' ' A' ' 32' ' ' THR . 2.9 tm? -121.98 112.85 18.79 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.1 t -93.36 115.23 31.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 -172.07 18.12 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.752 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.35 136.06 54.82 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.923 0.392 . . . . 0.0 110.918 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.438 HG21 HD21 ' A' ' 71' ' ' LEU . 13.0 t -85.59 93.82 3.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.497 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 m -82.64 -34.98 12.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.842 -178.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.7 mt -133.52 127.58 33.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.107 0.479 . . . . 0.0 110.613 178.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -111.92 126.27 54.93 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.271 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 37.0 t70 -128.21 166.4 18.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 81.1 m-20 -67.77 106.56 2.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.835 0.35 . . . . 0.0 110.141 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 47.7 mt-10 78.82 5.81 2.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.645 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.797 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 9.3 mpt_? -127.83 119.61 26.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.914 0.388 . . . . 0.0 110.955 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.536 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -110.27 107.98 17.93 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.695 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 62.8 mt -85.73 104.35 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.49 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.435 ' CD2' HG22 ' A' ' 20' ' ' VAL . 36.5 mt -111.54 151.74 28.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.529 -171.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.472 HG22 ' H ' ' A' ' 33' ' ' ASP . 58.6 mt -97.45 123.71 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 168.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.488 ' HA ' HD11 ' A' ' 16' ' ' LEU . 12.2 p -78.6 -10.59 59.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.018 0.437 . . . . 0.0 111.396 -177.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.494 ' OD1' ' HG3' ' A' ' 35' ' ' LYS . 6.1 t70 -89.64 162.05 15.81 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.9 p -100.96 9.59 42.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.494 ' HG3' ' OD1' ' A' ' 33' ' ' ASP . 68.0 mttm -77.25 131.7 38.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.238 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.5 122.79 73.39 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.504 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 165.89 30.94 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.797 2.332 . . . . 0.0 112.168 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.72 -172.59 27.96 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.776 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.77 -41.27 99.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.027 0.441 . . . . 0.0 110.488 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 34.4 tt0 -64.71 -37.12 86.52 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.39 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.457 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.0 m-20 -60.53 -45.03 95.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -70.88 -14.35 62.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.527 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -93.91 -15.44 24.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.752 0.31 . . . . 0.0 110.749 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.3 mt -72.53 154.19 40.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.2 176.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.1 p -84.98 170.14 13.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -176.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -50.24 -48.75 54.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.236 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.3 -43.18 99.45 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.616 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -70.92 -35.96 72.46 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.77 -0.253 . . . . 0.0 111.348 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 41' ' ' ASP . 67.3 mt -68.91 -36.92 78.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.89 0.376 . . . . 0.0 110.471 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.494 ' HA ' HG21 ' A' ' 57' ' ' ILE . 42.6 ttm -61.78 -34.58 76.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.504 176.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -82.71 -44.35 15.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.319 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.09 -34.32 74.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -114.41 43.1 1.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.121 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -50.63 119.53 3.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.107 -176.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 69.15 0.19 2.73 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.75 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -96.15 -20.42 18.62 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 170.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.494 HG21 ' HA ' ' A' ' 50' ' ' MET . 8.4 tt -90.24 123.32 42.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.358 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -125.51 125.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.251 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.656 HG12 HG12 ' A' ' 29' ' ' ILE . 58.0 mt -94.57 108.86 21.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 ' HB3' ' A' ' 92' ' ' ALA . 24.8 m -98.25 143.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.471 . . . . 0.0 110.88 -179.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.44 134.0 12.7 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.102 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.546 HD22 HG21 ' A' ' 68' ' ' THR . 69.4 mt -105.42 16.33 25.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.827 0.346 . . . . 0.0 110.245 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.2 m -60.54 -33.07 72.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.303 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.41 -33.87 61.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.684 0.278 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.7 mt -108.33 97.73 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.304 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.51 6.78 22.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.28 0.562 . . . . 0.0 110.88 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -99.12 14.51 29.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.21 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.546 HG21 HD22 ' A' ' 62' ' ' LEU . 6.9 p -86.4 7.64 24.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.62 -12.46 59.5 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.281 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.77 -19.99 61.93 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.981 174.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.438 HD21 HG21 ' A' ' 20' ' ' VAL . 25.3 tp -67.54 147.35 52.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.61 178.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -119.47 172.4 7.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.185 0.516 . . . . 0.0 111.73 -178.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -84.9 126.25 33.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.489 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.11 26.31 19.3 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -175.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -95.64 160.04 14.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 111.142 -173.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HG2' HD12 ' A' ' 100' ' ' LEU . 46.4 tttp -117.92 111.31 18.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -177.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.49 HG22 HD12 ' A' ' 99' ' ' LEU . 44.5 pt -132.4 171.84 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.745 0.783 . . . . 0.0 112.943 -173.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -133.45 111.65 10.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.882 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.493 ' HB ' HG21 ' A' ' 94' ' ' ILE . 34.9 m -106.62 157.43 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -117.39 123.06 45.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.098 172.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -126.22 157.71 37.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.813 0.34 . . . . 0.0 110.554 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -87.4 -36.88 17.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.093 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.8 t -150.11 168.61 23.42 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.238 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -123.77 132.0 53.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -110.21 95.24 5.46 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -82.81 84.6 7.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.198 0.523 . . . . 0.0 110.996 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 m -84.78 -12.47 53.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.115 175.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 60.31 89.99 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.546 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.482 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 58.3 Cg_endo -70.13 151.24 92.23 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.877 -1.301 . . . . 0.0 113.132 2.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 11.0 Cg_exo -71.14 153.11 62.58 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.096 2.53 . . . . 0.0 113.107 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 t -135.4 160.91 36.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.654 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.542 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.14 170.66 21.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 23.9 m -131.74 130.9 42.51 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.493 HG21 ' HB ' ' A' ' 79' ' ' VAL . 44.5 pt -109.09 145.05 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.966 0.412 . . . . 0.0 111.158 -176.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -109.13 -16.24 14.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -161.71 147.72 13.78 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -152.19 164.9 36.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -114.8 136.45 53.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.867 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.49 HD12 HG22 ' A' ' 77' ' ' ILE . 29.8 tp -92.26 118.88 31.32 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.544 HD12 ' HG2' ' A' ' 76' ' ' LYS . 93.7 mt -83.43 119.03 24.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.196 0.522 . . . . 0.0 110.582 -176.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.4 mt -75.52 -1.6 25.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.529 -176.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.2 -14.15 62.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.198 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 t60 -56.04 -51.95 65.99 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.441 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -119.19 81.63 1.74 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.167 0.508 . . . . 0.0 109.642 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.85 121.53 17.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.974 -177.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 35.0 m80 -85.4 120.33 26.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -113.56 135.37 53.98 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.737 -0.649 . . . . 0.0 109.891 -178.073 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.9 mtp . . . . . 0 N--CA 1.482 1.158 0 CA-C-O 120.533 0.206 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -99.04 129.14 45.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 0.0 111.525 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -79.39 -33.01 43.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 169.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -110.52 105.99 15.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.751 173.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.22 -57.06 11.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.454 -174.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.51 89.38 6.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.1 0.476 . . . . 0.0 110.305 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -85.05 98.42 10.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.545 0.688 . . . . 0.0 110.332 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -141.19 135.33 6.82 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.113 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -69.25 95.39 0.77 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.453 0.645 . . . . 0.0 110.146 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -163.01 -50.61 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.208 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 p -93.96 90.0 6.29 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.029 169.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -76.61 143.55 40.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.344 0.593 . . . . 0.0 111.446 -173.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.408 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 67.4 mtm -90.94 123.77 34.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.749 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.39 116.55 22.54 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.511 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 12.3 t -103.9 144.57 31.33 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.199 0.523 . . . . 0.0 111.694 -171.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.0 OUTLIER -135.52 136.99 41.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.493 ' N ' HD13 ' A' ' 16' ' ' LEU . 58.7 t -106.19 124.11 61.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.7 0.286 . . . . 0.0 110.393 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.25 167.72 29.0 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.11 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -104.94 128.01 53.02 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.502 HG21 HD11 ' A' ' 71' ' ' LEU . 21.9 t -75.69 99.2 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.454 HG12 ' CE2' ' A' ' 42' ' ' TYR . 34.6 m -98.27 -38.73 7.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.671 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 94.4 mt -131.46 131.5 43.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.667 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -116.07 119.77 36.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.548 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -88.42 -73.69 0.49 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.396 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.5 t30 171.73 -64.13 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.66 -25.72 21.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.141 175.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.9 OUTLIER -116.55 151.89 35.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.694 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.546 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.35 127.84 41.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.65 173.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.731 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 68.0 mt -89.68 107.93 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.2 mt -111.24 137.72 48.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.486 -177.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.448 HD11 HD13 ' A' ' 49' ' ' LEU . 9.7 mt -105.27 148.76 9.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.484 HG21 HD11 ' A' ' 16' ' ' LEU . 19.1 p -128.76 155.18 45.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.268 -176.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 54.28 41.26 32.08 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.631 0.582 . . . . 0.0 111.122 176.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -108.77 -4.59 16.81 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.011 -175.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.37 36.06 23.26 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.956 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 64.34 107.45 0.03 OUTLIER Pre-proline 0 N--CA 1.464 0.253 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.87 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 26.4 Cg_endo -63.14 163.67 22.14 Favored 'Trans proline' 0 C--O 1.237 0.443 0 C-N-CA 122.802 2.334 . . . . 0.0 112.293 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.459 ' O ' ' HD1' ' A' ' 42' ' ' TYR . . . -89.82 172.22 38.54 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.887 -178.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.18 -25.54 68.12 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.659 0.266 . . . . 0.0 111.128 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.88 -29.96 56.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.071 0.462 . . . . 0.0 110.175 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -69.95 -35.7 74.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.459 ' HD1' ' O ' ' A' ' 38' ' ' GLY . 69.3 m-85 -71.12 -16.21 62.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.458 174.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -83.41 -28.94 28.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.045 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -67.9 142.55 56.03 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.306 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 m -91.32 -174.14 3.84 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.474 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -52.55 -56.22 16.75 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.026 -173.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.91 92.74 Favored Glycine 0 N--CA 1.454 -0.144 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.388 -177.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.63 -39.33 80.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.578 0.228 . . . . 0.0 111.148 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD13 HD11 ' A' ' 31' ' ' ILE . 90.7 mt -78.26 -35.67 47.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.964 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 42.9 ttm -58.83 -42.73 89.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -93.24 2.76 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.463 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -100.56 -40.48 7.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.196 0.522 . . . . 0.0 109.76 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 56' ' ' ASN . 81.0 m-85 -118.58 55.58 0.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.59 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -51.5 -35.95 42.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.5 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -100.42 -8.77 22.88 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.593 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 53' ' ' PHE . 2.9 m-20 -114.02 2.03 14.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -171.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 12.6 tt -98.48 123.74 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.113 0.482 . . . . 0.0 110.861 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -125.02 126.02 70.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.967 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 91' ' ' SER . 61.6 mt -97.84 105.18 16.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.9 m -90.68 150.44 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.277 -176.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.66 119.59 6.53 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.883 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 28' ' ' ALA . 35.4 mt -92.33 7.99 40.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.09 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.0 t -65.46 -23.69 66.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.296 -170.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -97.72 5.52 49.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.088 0.47 . . . . 0.0 111.214 -175.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 52.3 mt -95.75 154.96 3.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.253 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -68.93 0.13 Allowed 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.363 0.414 . . . . 0.0 110.928 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -163.41 131.04 3.55 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.507 HG21 HD13 ' A' ' 62' ' ' LEU . 37.0 p -97.29 35.3 1.63 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.039 -174.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -68.28 -22.56 64.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.091 -177.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -92.95 5.93 49.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.112 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.502 HD11 HG21 ' A' ' 20' ' ' VAL . 24.1 tp -99.02 121.19 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.365 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -114.1 -172.57 2.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.954 0.407 . . . . 0.0 110.544 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -85.47 146.1 27.11 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.479 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 76.46 39.93 29.19 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.636 174.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -127.02 158.62 36.45 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.619 -177.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 38.5 mttp -102.62 136.45 42.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.4 pt -133.1 140.44 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.336 0.589 . . . . 0.0 111.25 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 88.0 tttt -100.29 106.82 18.5 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 173.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 15' ' ' SER . 29.2 m -100.16 154.11 4.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.582 -172.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.507 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 18.6 m-90 -120.61 117.65 28.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.414 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.615 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -133.88 167.15 21.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.825 -175.354 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -152.37 -37.7 0.11 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.739 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 7.1 m -80.23 108.02 13.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.451 176.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -102.52 153.51 20.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.148 0.499 . . . . 0.0 111.532 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 98.0 mttt -133.6 114.01 13.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.747 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.9 58.31 3.35 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.852 0.834 . . . . 0.0 109.697 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.6 t -76.37 -16.4 59.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.171 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 p30 42.92 100.08 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 112.382 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.15 150.07 75.3 Favored 'Cis proline' 0 C--N 1.345 0.381 0 C-N-CA 123.804 -1.332 . . . . 0.0 113.053 3.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.47 136.54 74.96 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.014 2.476 . . . . 0.0 112.524 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.645 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 19.7 m -115.72 149.03 39.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.567 177.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 81' ' ' PHE . . . -143.53 121.63 12.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.794 0.33 . . . . 0.0 111.258 -177.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 29.3 m -82.07 113.67 20.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.615 HG22 ' HB3' ' A' ' 81' ' ' PHE . 35.2 pt -96.18 142.58 13.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.033 0.444 . . . . 0.0 110.697 -177.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -90.59 -19.28 23.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.092 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -171.01 150.26 3.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.655 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.77 157.94 31.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.507 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 23.2 tt0 -115.54 112.34 22.06 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.5 tp -71.58 107.18 4.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.739 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.416 ' HB2' ' HB2' ' A' ' 76' ' ' LYS . 78.5 mt -81.83 90.8 6.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.477 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.05 140.89 57.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.484 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 108' ' ' HIS . 21.4 mm-40 -67.35 -175.8 0.52 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.614 0.721 . . . . 0.0 112.431 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -99.71 -0.93 39.08 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.802 -167.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.43 ' HB2' ' H ' ' A' ' 108' ' ' HIS . 72.6 m80 -137.69 152.22 49.05 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.749 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -84.11 -34.92 24.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.27 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -130.24 42.12 3.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.861 0.363 . . . . 0.0 111.731 -176.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' HB3' ' H ' ' A' ' 108' ' ' HIS . 5.6 t-80 -160.71 -87.36 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.054 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' HIS . . . . . 0.491 ' O ' ' HB3' ' A' ' 102' ' ' GLU . 54.0 t60 . . . . . 0 C--O 1.238 0.45 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.452 ' HB3' ' H ' ' A' ' 2' ' ' ASN . 56.7 mtt . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.814 0.34 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.452 ' H ' ' HB3' ' A' ' 1' ' ' MET . 1.7 m-20 -54.48 -47.59 72.81 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -169.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 tttt -74.12 -9.49 58.68 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.773 -173.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -67.96 -10.98 57.77 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.061 0.458 . . . . 0.0 111.099 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -80.66 -30.02 36.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.161 176.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -129.71 103.47 6.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.595 -175.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.1 m-20 -59.97 -39.65 86.4 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.85 -110.34 3.12 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.2 -0.909 . . . . 0.0 113.919 170.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -64.88 -19.39 65.88 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -171.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -90.03 -0.85 57.81 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.303 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.1 p -132.29 122.15 24.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.888 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -87.35 119.3 27.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.574 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 95.8 mmm -98.24 130.68 44.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.267 175.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 83.9 mm-40 -83.38 118.62 23.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 111.195 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 m -81.15 111.9 18.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.544 HD11 HG22 ' A' ' 32' ' ' THR . 2.0 tm? -130.92 124.89 32.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.75 132.3 37.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.786 0.327 . . . . 0.0 110.327 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.59 162.78 28.93 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.755 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -105.84 126.03 51.7 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.576 0.227 . . . . 0.0 110.648 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.44 107.62 4.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.467 HG13 ' HG ' ' A' ' 22' ' ' LEU . 12.2 p -120.23 -32.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 123.271 0.357 . . . . 0.0 111.062 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.992 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.9 mt -127.73 145.07 51.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.818 0.342 . . . . 0.0 110.999 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -119.1 135.8 54.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.35 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 0.9 OUTLIER -92.77 -66.77 0.9 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.141 171.128 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 6.1 t30 160.9 -51.45 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.18 -24.76 14.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.406 -1.27 . . . . 0.0 108.69 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 24.3 mtm180 -117.92 158.95 23.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.607 -1.178 . . . . 0.0 110.464 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -124.61 139.87 53.47 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 175.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 32.5 mt -102.41 109.29 26.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 mt -113.16 144.39 42.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.047 -172.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.76 119.74 35.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.883 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 HD11 ' A' ' 16' ' ' LEU . 75.9 p -81.78 -23.66 36.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.959 0.409 . . . . 0.0 110.665 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.401 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 38.7 t70 -78.48 95.08 5.05 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 174.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 t -63.88 90.69 0.06 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.155 0.978 . . . . 0.0 112.127 -173.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -138.35 135.56 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.656 -1.157 . . . . 0.0 108.356 172.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.35 113.24 15.41 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.498 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.0 158.02 50.27 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.62 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.37 168.99 48.92 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.938 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -64.1 -28.12 69.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.948 0.404 . . . . 0.0 110.593 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -81.38 -26.56 35.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.911 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.67 -34.73 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -69.33 -16.19 63.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.665 175.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -94.53 -18.06 21.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.772 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.92 152.87 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.117 0.484 . . . . 0.0 110.953 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.3 p -77.51 166.62 22.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.322 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HA ' ' CD1' ' A' ' 22' ' ' LEU . 37.2 tt0 -52.77 -52.69 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.936 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.68 -42.13 99.71 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.686 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -68.04 -37.38 81.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.754 0.277 . . . . 0.0 111.654 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.525 HD12 HD21 ' A' ' 22' ' ' LEU . 72.8 mt -70.42 -34.17 72.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.796 0.331 . . . . 0.0 110.501 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.415 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 62.7 mtt -73.22 -15.7 61.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.094 176.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -91.04 -40.16 11.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.861 0.363 . . . . 0.0 110.35 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.31 -47.71 69.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.449 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.65 46.86 0.94 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.81 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 50' ' ' MET . 57.0 tttp -56.27 131.14 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -176.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 69.19 -5.52 1.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.276 -0.874 . . . . 0.0 112.206 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 29.0 m-80 -106.14 9.75 32.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.579 0.704 . . . . 0.0 109.495 176.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 29' ' ' ILE . 20.2 tt -120.48 128.62 76.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.603 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HG2' ' A' ' 90' ' ' PRO . 53.7 t -121.98 137.84 54.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.893 0.378 . . . . 0.0 110.969 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 91' ' ' SER . 56.5 mt -95.93 111.13 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.97 139.03 18.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.155 0.502 . . . . 0.0 111.231 -177.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -87.57 113.09 3.93 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.573 HD11 ' HB2' ' A' ' 28' ' ' ALA . 59.5 mt -87.55 43.13 1.09 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.026 0.441 . . . . 0.0 110.39 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.4 t -59.52 -45.51 91.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.654 -176.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 1.1 mp0 -87.86 11.09 16.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.05 0.453 . . . . 0.0 111.27 -176.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 62' ' ' LEU . 51.4 mm -106.45 134.38 48.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.44 -64.27 1.21 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.163 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -123.69 140.64 52.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.7 p -111.45 27.58 9.54 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.163 0.506 . . . . 0.0 111.551 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -73.01 -25.13 60.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.189 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -74.59 -27.22 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.692 0.282 . . . . 0.0 111.118 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.06 125.13 25.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -114.74 150.98 34.49 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 48.2 mtm105 -68.83 112.46 5.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 171.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.0 33.38 4.67 Favored Glycine 0 N--CA 1.443 -0.897 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 -174.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -118.53 151.38 37.96 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.498 ' HG2' HD12 ' A' ' 100' ' ' LEU . 81.1 tttt -111.8 122.99 49.3 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.827 0.346 . . . . 0.0 110.755 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.489 HG22 HD12 ' A' ' 99' ' ' LEU . 38.2 pt -132.14 149.6 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.296 0.57 . . . . 0.0 111.347 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -105.96 108.13 19.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 97' ' ' TYR . 28.2 m -98.66 153.02 4.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.255 0.55 . . . . 0.0 111.632 -173.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.574 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 8.5 m-90 -121.2 113.46 20.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.802 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 94' ' ' ILE . 30.4 p90 -107.24 146.93 30.84 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.619 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -99.22 -25.17 14.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.326 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -160.29 152.59 20.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 92' ' ' ALA . 32.9 mtm180 -110.25 169.75 8.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.344 0.592 . . . . 0.0 111.064 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 91' ' ' SER . 57.5 tttp -140.74 91.39 2.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.015 -0.993 . . . . 0.0 108.47 173.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 35.2 tt0 -83.96 109.81 17.92 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.363 -173.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -121.08 -0.27 10.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.417 174.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 59.37 102.08 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.47 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.212 -175.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.42 146.07 72.14 Favored 'Cis proline' 0 C--N 1.344 0.301 0 C-N-CA 123.563 -1.432 . . . . 0.0 112.24 0.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.532 ' HG2' HG22 ' A' ' 58' ' ' VAL . 20.6 Cg_endo -62.82 138.78 70.82 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.489 2.126 . . . . 0.0 112.202 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 28.2 t -104.0 156.09 18.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 84' ' ' ARG . . . -147.56 108.58 4.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.685 0.278 . . . . 0.0 110.911 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.4 m -73.02 110.08 7.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.859 0.361 . . . . 0.0 110.601 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 81' ' ' PHE . 45.4 pt -98.95 147.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.356 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.686 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 96.7 mt-30 -109.61 -8.98 14.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.581 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -165.98 148.74 7.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.172 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.512 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -137.35 167.37 21.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 172.475 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -129.32 131.06 46.84 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.489 HD12 HG22 ' A' ' 77' ' ' ILE . 17.4 tp -79.17 111.87 15.83 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -178.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.498 HD12 ' HG2' ' A' ' 76' ' ' LYS . 86.0 mt -82.5 130.4 35.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.983 -178.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.4 mt -95.26 130.84 41.86 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.6 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -67.52 107.9 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -83.43 69.43 10.03 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.337 0.589 . . . . 0.0 109.792 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -72.17 151.93 42.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -72.96 -24.98 60.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.257 -175.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 82.6 t60 69.46 16.33 8.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.808 0.814 . . . . 0.0 109.504 -173.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -86.28 -17.68 33.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 43.1 m80 . . . . . 0 C--O 1.247 0.968 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.155 174.801 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -74.42 -29.67 61.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 171.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -105.73 99.21 8.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.633 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -105.76 172.94 6.53 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.196 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -79.86 68.79 6.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.436 0.636 . . . . 0.0 111.547 -172.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -171.34 -66.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.581 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -91.38 41.89 1.08 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 0.0 110.737 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -169.02 31.51 0.17 Allowed Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.494 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.478 ' CG ' ' H ' ' A' ' 10' ' ' GLU . 11.2 t70 -112.89 -164.03 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' H ' ' CG ' ' A' ' 9' ' ' ASP . 35.2 mt-10 -124.85 -20.41 5.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.744 0.307 . . . . 0.0 111.113 -175.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.1 t -83.69 148.62 26.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.161 0.505 . . . . 0.0 110.763 -177.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.38 90.89 3.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.687 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.434 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 72.8 mtp -119.99 140.61 50.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.333 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.4 mt-30 -88.67 135.3 33.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.848 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 35.8 p -101.67 139.43 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.634 -174.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.3 tp -140.34 120.82 14.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.542 177.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.434 HG22 ' HB2' ' A' ' 78' ' ' LYS . 55.9 t -90.23 127.01 43.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.293 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.64 158.6 27.73 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.148 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.791 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 80.0 m-85 -99.37 129.77 45.6 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.8 t -83.07 108.4 15.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.227 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.2 m -103.34 -28.48 3.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 123.318 0.386 . . . . 0.0 111.033 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 29' ' ' ILE . 39.2 tp -136.21 122.82 20.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.869 0.366 . . . . 0.0 110.55 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -105.96 123.57 48.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.659 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -113.04 167.57 10.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.84 -31.96 68.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.63 0.252 . . . . 0.0 111.517 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -122.76 1.86 9.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.593 0.235 . . . . 0.0 111.324 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -142.83 167.78 21.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.82 0.343 . . . . 0.0 110.665 -174.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.496 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.72 119.66 9.35 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.8 173.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.923 HD12 HD23 ' A' ' 22' ' ' LEU . 33.3 mt -85.73 107.86 16.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-O 121.217 0.532 . . . . 0.0 110.014 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.458 HD22 HG22 ' A' ' 20' ' ' VAL . 20.2 mt -110.44 141.94 42.85 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.163 -176.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.4 mt -101.92 122.13 53.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -71.47 91.77 1.06 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.083 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.791 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 45.9 t0 65.22 93.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.848 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.44 10.66 40.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.233 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 56.13 35.66 26.06 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -172.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.43 102.98 0.03 OUTLIER Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.61 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.4 157.21 32.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.869 2.38 . . . . 0.0 112.391 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.11 166.85 39.11 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.641 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -57.67 -37.38 73.29 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.744 0.307 . . . . 0.0 111.06 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 19.2 mm-40 -73.84 -24.01 59.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.64 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.6 -33.87 71.53 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.52 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 80.5 m-85 -74.82 -17.92 60.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.363 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -90.12 -12.62 37.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.062 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 85.5 mt -67.42 166.14 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.129 0.49 . . . . 0.0 111.079 176.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.1 p -97.65 171.78 8.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.82 -55.8 23.35 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.303 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -57.9 -41.19 94.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.264 -0.493 . . . . 0.0 112.842 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -63.42 -44.38 94.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.738 0.304 . . . . 0.0 110.692 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.68 -42.74 98.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.405 ' HG2' HD13 ' A' ' 57' ' ' ILE . 88.9 mtp -60.22 -33.88 72.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.652 -179.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -92.22 -34.89 14.1 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -71.33 -47.78 54.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.9 0.381 . . . . 0.0 110.425 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -106.04 44.08 1.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.633 0.73 . . . . 0.0 109.86 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 81.3 tttt -54.62 140.6 34.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.246 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 92.7 m-20 76.37 -40.96 0.4 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.62 0.768 . . . . 0.0 112.329 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -80.83 -1.04 41.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 0.0 110.806 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.517 HG23 ' HB3' ' A' ' 89' ' ' PRO . 7.4 tt -90.8 118.77 36.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.308 0.575 . . . . 0.0 110.43 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -117.92 125.19 74.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.108 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.679 HG12 HG12 ' A' ' 29' ' ' ILE . 55.1 mt -99.49 100.35 10.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 35.5 m -83.66 154.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.412 ' CA ' ' HA ' ' A' ' 93' ' ' THR . . . -96.41 125.95 8.63 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.934 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.57 ' HB3' HG21 ' A' ' 68' ' ' THR . 86.6 mt -109.31 9.74 25.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 -178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -64.78 -21.99 66.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.451 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -91.88 0.66 57.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.709 0.29 . . . . 0.0 111.156 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.34 117.8 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.868 0.365 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.76 -55.88 6.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.047 0.451 . . . . 0.0 111.658 -176.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -85.35 66.85 9.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.208 0.528 . . . . 0.0 111.736 -173.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 62' ' ' LEU . 69.1 p -99.54 8.9 44.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.229 172.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.79 -18.92 65.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.731 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -77.51 -12.43 59.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.302 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 15.5 tp -87.92 126.25 34.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.792 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.407 ' HD2' ' OE2' ' A' ' 75' ' ' GLU . 35.8 mttt -112.76 -179.82 3.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.133 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -88.57 59.56 5.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.85 0.357 . . . . 0.0 110.417 174.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.52 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 176.54 42.61 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HG3' HD12 ' A' ' 71' ' ' LEU . 40.5 mm-40 -111.87 173.18 6.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.288 0.566 . . . . 0.0 111.441 -173.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -137.48 102.23 4.72 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.641 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.1 pt -125.44 154.9 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.764 0.793 . . . . 0.0 113.093 -170.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.495 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 43.3 tttt -115.77 106.44 13.86 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.301 -1.318 . . . . 0.0 108.551 175.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 15' ' ' SER . 22.1 m -96.14 156.86 3.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -169.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.495 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 5.4 m-90 -122.99 126.44 47.16 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.338 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -136.86 160.16 39.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.584 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -96.45 -23.08 16.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -157.57 158.51 35.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.124 -174.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -122.98 154.16 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.18 0.514 . . . . 0.0 110.805 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -103.68 102.51 12.37 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -77.85 62.24 2.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.911 -175.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.7 p -81.66 -30.15 32.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.031 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 66.3 101.72 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.42 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.669 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.517 ' HB3' HG23 ' A' ' 57' ' ' ILE . 31.3 Cg_endo -63.11 142.13 42.3 Favored 'Cis proline' 0 C--N 1.347 0.484 0 C-N-CA 123.779 -1.342 . . . . 0.0 112.657 2.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 34.3 Cg_exo -58.91 134.91 63.26 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.79 2.327 . . . . 0.0 112.159 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.3 p -123.45 144.59 49.41 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.85 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -151.26 110.3 3.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.285 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.412 ' HA ' ' CA ' ' A' ' 61' ' ' GLY . 12.8 m -68.29 117.25 9.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.216 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG21 ' HB ' ' A' ' 79' ' ' VAL . 42.5 pt -100.6 151.77 5.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.154 0.502 . . . . 0.0 110.938 -176.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -112.78 -18.65 12.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.338 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -143.1 151.13 40.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.777 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 94' ' ' ILE . 1.2 p90 -155.93 150.01 25.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.965 0.412 . . . . 0.0 110.02 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.44 124.47 52.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.413 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.63 117.67 23.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.952 0.406 . . . . 0.0 110.393 -177.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt -111.94 -179.85 3.81 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.084 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.644 ' HG ' ' H ' ' A' ' 102' ' ' GLU . 26.8 tp -157.92 -176.74 6.1 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.408 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.644 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 7.2 mm-40 -78.68 175.92 9.97 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -86.33 20.86 2.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.64 0.733 . . . . 0.0 109.708 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -140.74 169.73 17.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.149 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -68.06 -32.78 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.067 -0.253 . . . . 0.0 111.324 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -121.36 -90.71 0.57 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.053 0.454 . . . . 0.0 109.885 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -147.99 -51.85 0.18 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 68.9 t60 . . . . . 0 C--O 1.246 0.89 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.35 171.911 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.5 mtt . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -144.99 99.02 3.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -77.57 158.34 29.89 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.579 0.704 . . . . 0.0 112.181 -174.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.723 HD21 ' HB3' ' A' ' 6' ' ' GLN . 16.3 t30 -109.48 125.77 52.81 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.872 174.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.49 -28.85 66.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.979 0.419 . . . . 0.0 110.423 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.723 ' HB3' HD21 ' A' ' 4' ' ' ASN . 42.0 tt0 -59.3 -33.23 70.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 173.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 57.8 t30 60.25 92.58 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.578 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -148.25 -160.24 8.9 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.354 -0.699 . . . . 0.0 111.354 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -89.38 -14.63 35.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.063 0.458 . . . . 0.0 109.856 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 67.93 31.45 5.64 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.703 176.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -90.14 10.88 22.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.752 0.787 . . . . 0.0 109.29 171.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 14.6 pttm -75.67 117.6 17.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.438 0.637 . . . . 0.0 109.986 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 70.3 mtm -107.89 125.78 51.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.264 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -83.66 121.11 26.82 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.263 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.517 ' HB3' ' HE2' ' A' ' 78' ' ' LYS . 48.8 m -85.42 129.24 34.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.123 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 16' ' ' LEU . 1.1 tm? -137.5 124.56 21.54 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.8 t -90.31 126.67 43.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.99 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.44 169.31 29.05 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.359 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.415 ' CD2' ' HG2' ' A' ' 76' ' ' LYS . 94.2 m-85 -107.14 133.96 50.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.657 0.265 . . . . 0.0 110.353 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 20.0 t -85.39 110.27 19.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.34 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.8 t -107.23 -63.19 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 123.497 0.498 . . . . 0.0 110.704 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 1.018 HD23 HD12 ' A' ' 29' ' ' ILE . 41.6 tp -111.51 110.47 20.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.948 0.404 . . . . 0.0 110.702 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HE3' ' HA ' ' A' ' 69' ' ' ASP . 42.6 tttm -100.01 126.58 46.22 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 15.7 t70 -106.27 -158.08 0.64 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 174.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.452 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 72.9 m-20 -89.1 -54.72 3.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.172 0.511 . . . . 0.0 109.747 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -98.26 -10.72 23.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.027 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.2 mtt180 -131.87 149.7 52.37 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.733 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -127.13 115.36 19.0 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 172.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 1.018 HD12 HD23 ' A' ' 22' ' ' LEU . 34.7 mt -87.94 107.55 17.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.394 0.616 . . . . 0.0 110.396 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.3 mt -114.32 158.13 21.86 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.416 -176.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.55 ' CG2' ' HB ' ' A' ' 34' ' ' THR . 36.9 mt -110.37 123.8 66.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.3 p -78.14 107.85 11.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.375 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 54.05 75.49 0.27 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.634 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.55 ' HB ' ' CG2' ' A' ' 31' ' ' ILE . 10.0 t -108.56 -0.01 20.56 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.637 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.8 mttp 57.11 41.18 27.67 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.837 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.98 112.57 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.8 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.536 ' HG3' HG21 ' A' ' 34' ' ' THR . 6.5 Cg_exo -73.03 178.88 5.95 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.833 2.356 . . . . 0.0 111.469 176.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.5 166.23 25.27 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.31 -178.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -62.79 -27.21 69.15 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.6 mt-10 -59.71 -47.6 85.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.363 174.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -67.04 -32.87 74.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.833 -175.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.503 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 53.6 m-85 -73.45 -16.44 61.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 111.058 177.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -93.44 -22.14 19.08 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.07 0.462 . . . . 0.0 110.143 178.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 89.7 mt -69.52 157.1 37.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.056 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -88.1 179.07 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.363 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -58.9 -43.58 91.06 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.346 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.8 -42.27 93.13 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.478 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mt-30 -64.16 -39.53 94.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.065 0.46 . . . . 0.0 110.429 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.2 tp -68.96 -48.38 63.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.34 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.439 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 41.3 ttm -55.88 -49.02 74.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.918 -174.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -81.98 -8.43 59.67 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -90.11 -51.5 5.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.003 0.43 . . . . 0.0 110.408 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -101.75 33.24 3.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -56.89 -29.52 63.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -170.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -101.44 3.43 40.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.452 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -132.84 18.16 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.124 0.487 . . . . 0.0 110.063 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.449 HD11 ' CG2' ' A' ' 29' ' ' ILE . 17.5 tt -109.75 134.08 52.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.744 -174.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.4 t -132.64 122.59 47.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.042 0.448 . . . . 0.0 110.448 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.715 HG12 HG12 ' A' ' 29' ' ' ILE . 48.4 mt -92.99 103.62 14.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.46 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.477 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.0 m -83.1 145.64 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.136 0.493 . . . . 0.0 110.714 -178.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.75 122.41 6.65 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.103 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.529 ' HB3' HG21 ' A' ' 68' ' ' THR . 68.5 mt -98.98 11.62 38.41 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.925 0.426 . . . . 0.0 110.188 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 m -57.42 -25.16 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.675 -174.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -98.37 6.47 47.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.158 0.504 . . . . 0.0 111.015 -176.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.0 mt -125.25 107.02 17.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -84.63 21.19 1.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.817 0.341 . . . . 0.0 111.792 -174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -157.77 81.58 0.87 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.16 0.505 . . . . 0.0 109.769 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 62' ' ' LEU . 10.2 p -114.21 9.08 17.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.908 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 41.7 m-20 -79.49 2.67 21.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.115 0.483 . . . . 0.0 111.292 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -82.29 -13.7 56.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.576 170.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.8 tp -76.2 130.63 38.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.468 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.568 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 4.2 mtpm? -106.02 165.12 11.44 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.393 -177.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -89.96 123.8 34.19 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 175.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.503 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 98.01 37.5 4.38 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.754 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.568 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 67.4 mm-40 -116.61 175.75 5.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 111.74 -174.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HG2' ' CD2' ' A' ' 19' ' ' TYR . 52.9 mtpt -124.44 123.57 40.44 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.182 177.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.5 pt -135.41 153.76 34.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.622 0.725 . . . . 0.0 112.294 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 98' ' ' GLU . 56.0 tttm -110.39 106.52 15.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.588 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 26.7 m -94.56 154.29 3.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.148 0.499 . . . . 0.0 112.179 -172.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.7 m0 -118.47 104.13 10.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.455 175.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.547 ' HB3' HG22 ' A' ' 94' ' ' ILE . 53.1 p90 -117.67 145.48 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.08 0.467 . . . . 0.0 110.637 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -99.29 -39.19 8.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.4 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 38.4 m -120.34 124.32 45.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.274 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -117.85 118.69 32.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.822 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -117.84 115.86 25.82 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.084 0.468 . . . . 0.0 109.76 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.517 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 36.2 mt-10 -87.95 85.61 7.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.286 0.565 . . . . 0.0 110.544 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 m -91.23 -6.62 53.08 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.633 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 50.1 t30 66.68 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.538 -176.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 61.4 Cg_endo -75.01 156.35 99.91 Favored 'Cis proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.375 -1.51 . . . . 0.0 112.641 -0.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.3 Cg_exo -61.28 141.2 92.2 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.914 2.409 . . . . 0.0 112.686 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.9 t -132.29 141.51 49.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.863 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.442 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -138.32 130.78 29.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.668 0.27 . . . . 0.0 110.775 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.6 m -83.68 119.76 25.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.547 HG22 ' HB3' ' A' ' 81' ' ' PHE . 44.9 pt -102.66 150.4 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.85 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.66 -48.96 4.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.101 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -140.67 169.7 17.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.457 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -155.72 158.11 37.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 0.0 110.895 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 78' ' ' LYS . 43.1 mt-10 -114.57 121.76 44.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.269 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 tp -72.9 121.48 20.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.2 mt -94.48 110.68 22.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.049 0.452 . . . . 0.0 110.49 -177.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.85 160.4 31.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.494 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.486 ' HG2' ' H ' ' A' ' 103' ' ' HIS . 0.5 OUTLIER -97.55 -175.81 3.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.727 0.299 . . . . 0.0 110.227 -177.227 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.486 ' H ' ' HG2' ' A' ' 102' ' ' GLU . 77.2 t60 -83.44 -38.73 21.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 -178.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -102.95 172.4 6.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -89.73 -13.43 36.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.373 0.606 . . . . 0.0 109.502 173.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -116.5 157.12 25.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.301 177.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -107.11 -34.66 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.132 0.492 . . . . 0.0 109.774 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 9.8 m170 . . . . . 0 C--O 1.245 0.821 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.219 175.576 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.593 0.235 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -109.49 -16.66 13.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.762 0.315 . . . . 0.0 111.242 -176.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -111.62 -164.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.106 178.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -75.29 -21.2 58.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.091 0.472 . . . . 0.0 110.382 177.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.53 172.56 13.34 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.466 173.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -105.25 -72.06 0.72 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.689 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.0 t30 174.64 -48.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 O-C-N 123.813 0.695 . . . . 0.0 109.535 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -76.77 9.31 24.19 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.827 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.81 -34.71 78.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.354 0.597 . . . . 0.0 109.845 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -77.75 -36.67 50.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.726 -177.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -75.4 149.52 38.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.088 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -86.25 105.2 16.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.346 0.594 . . . . 0.0 110.925 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 75.2 mtp -90.86 128.61 36.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.232 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -90.74 130.24 36.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.791 0.329 . . . . 0.0 111.177 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -79.34 129.12 34.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.905 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.431 HD21 HG22 ' A' ' 32' ' ' THR . 1.5 tt -128.46 116.88 20.39 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.2 t -98.79 122.59 50.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 155.97 26.65 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.38 -178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.44 ' O ' ' HA ' ' A' ' 30' ' ' LEU . 83.7 m-85 -83.99 127.87 34.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.675 0.274 . . . . 0.0 111.012 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.405 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 16.1 t -81.25 96.49 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.0 m -97.02 -36.92 6.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.858 0.361 . . . . 0.0 111.257 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.667 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 81.1 mt -140.25 147.15 39.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -135.94 140.9 44.36 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.4 -177.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 34.8 t70 -121.0 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 46.9 t30 -82.32 -33.88 28.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.461 . . . . 0.0 110.169 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -95.3 -33.16 12.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.848 -177.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -139.31 164.92 28.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.918 0.39 . . . . 0.0 111.35 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.534 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.72 133.79 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.978 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 57' ' ' ILE . 71.0 mt -90.65 107.04 18.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.026 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 40.6 mt -112.83 136.81 52.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.619 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.586 HG22 ' H ' ' A' ' 33' ' ' ASP . 41.4 mt -95.33 120.04 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 174.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.431 HG22 HD21 ' A' ' 16' ' ' LEU . 20.6 p -90.25 22.89 3.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.969 -175.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.586 ' H ' HG22 ' A' ' 31' ' ' ILE . 7.4 t70 -97.31 -167.07 1.48 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.266 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -99.26 -23.44 15.19 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.222 0.534 . . . . 0.0 110.707 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -87.1 140.02 29.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.923 -177.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -98.84 130.98 26.46 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 168.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.475 ' HB3' ' CB ' ' A' ' 41' ' ' ASP . 57.3 Cg_exo -53.76 150.11 30.47 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.959 2.439 . . . . 0.0 112.876 -177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.72 -171.54 35.94 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.635 -0.793 . . . . 0.0 111.996 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.06 -42.88 77.3 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 122.614 0.366 . . . . 0.0 110.843 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.633 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.8 mt-10 -65.4 -41.22 93.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.944 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.475 ' CB ' ' HB3' ' A' ' 37' ' ' PRO . 16.0 m-20 -65.07 -44.74 87.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.414 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -68.96 -19.08 64.16 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.863 0.363 . . . . 0.0 111.201 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.84 -23.68 23.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.547 -178.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.0 mt -69.03 158.69 34.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.136 178.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -70.78 149.08 47.23 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -59.99 -31.64 70.11 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -172.651 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.01 -37.83 93.53 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.118 177.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 96.8 mt-30 -66.72 -49.04 67.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 177.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.83 -40.91 96.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.413 178.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 45.7 ttm -61.54 -33.77 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.785 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -81.19 -28.69 34.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.857 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 58.2 mtpt -64.18 -39.14 93.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.094 0.473 . . . . 0.0 110.291 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -113.46 43.39 1.77 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.64 178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -48.3 -37.71 17.07 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -116.72 13.53 15.16 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.346 -179.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -121.91 25.13 9.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.352 0.596 . . . . 0.0 109.491 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.77 HD11 HG23 ' A' ' 29' ' ' ILE . 10.2 tt -130.14 139.12 52.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.688 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.7 t -127.76 123.81 61.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' A' ' 91' ' ' SER . 58.6 mt -94.83 103.06 14.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.1 m -84.1 144.77 9.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.048 0.451 . . . . 0.0 111.329 -175.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.19 122.57 6.36 Favored Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.649 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.552 HD22 HG21 ' A' ' 68' ' ' THR . 63.4 mt -95.25 -4.03 46.47 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.778 0.34 . . . . 0.0 110.536 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 m -59.26 -24.68 63.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.489 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -76.69 -38.58 54.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.49 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.442 HG22 ' H ' ' A' ' 67' ' ' ASN . 45.9 mt -106.68 100.14 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.996 0.427 . . . . 0.0 110.887 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -80.23 8.36 7.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.148 0.499 . . . . 0.0 110.7 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.442 ' H ' HG22 ' A' ' 65' ' ' ILE . 86.5 m-20 -104.02 12.51 34.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.838 -177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.552 HG21 HD22 ' A' ' 62' ' ' LEU . 5.3 p -81.84 26.03 0.52 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -70.2 -36.63 74.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.868 0.366 . . . . 0.0 111.301 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.63 6.05 29.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.252 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.536 HD11 HD13 ' A' ' 77' ' ' ILE . 14.3 tp -71.54 115.83 11.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.944 0.402 . . . . 0.0 110.079 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 43.3 tttm -100.9 140.86 34.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.512 -174.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 74.1 mtt180 -72.78 152.53 41.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.283 173.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.29 41.39 38.24 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.696 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -143.24 -166.05 2.22 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HB2' ' A' ' 100' ' ' LEU . 63.1 pttt -144.28 145.45 32.03 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 99' ' ' LEU . 25.5 pt -135.47 152.08 31.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.268 0.556 . . . . 0.0 111.313 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -104.8 106.71 17.32 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.844 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 30.7 m -103.92 155.58 5.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.881 0.372 . . . . 0.0 111.434 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 6.6 m-90 -113.43 111.59 22.21 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.432 172.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 2.4 p90 -115.43 163.66 15.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.36 -175.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.34 -60.84 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -93.45 133.4 36.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.152 0.501 . . . . 0.0 111.547 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -115.91 117.11 29.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.365 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.713 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 67.2 mttm -85.97 135.28 33.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.962 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -92.6 42.52 1.1 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.995 -173.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.9 t -68.65 -31.84 71.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.843 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 48.6 t30 64.39 102.38 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.428 0 O-C-N 123.611 0.569 . . . . 0.0 110.705 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 27.2 Cg_exo -63.18 152.12 69.66 Favored 'Cis proline' 0 C--N 1.347 0.452 0 C-N-CA 124.076 -1.218 . . . . 0.0 113.022 2.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 45.6 Cg_exo -55.95 130.1 38.52 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.015 2.477 . . . . 0.0 112.275 -178.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.713 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 13.3 m -105.44 116.06 31.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.082 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -104.09 116.05 31.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.731 0.3 . . . . 0.0 111.215 -176.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.1 m -76.88 114.6 15.84 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.9 pt -96.65 139.04 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.915 0.388 . . . . 0.0 111.192 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -104.81 -25.87 12.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.786 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -147.72 163.64 36.06 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.639 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 2.6 p90 -162.01 150.35 15.0 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.989 0.423 . . . . 0.0 111.572 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -114.75 123.09 48.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.763 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.542 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -75.32 110.97 10.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.088 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.529 ' HB2' ' HG3' ' A' ' 76' ' ' LYS . 86.3 mt -91.49 107.26 19.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.105 0.479 . . . . 0.0 110.679 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.7 mt -90.55 145.35 24.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.649 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.451 ' OE1' ' HE2' ' A' ' 76' ' ' LYS . 10.3 mm-40 -86.71 -43.52 12.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.948 -175.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -98.95 133.61 42.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.759 0.314 . . . . 0.0 110.173 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -132.36 133.46 43.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.857 -177.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -85.07 170.99 12.41 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.924 0.392 . . . . 0.0 110.556 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -86.87 -7.8 57.87 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.24 0.543 . . . . 0.0 110.091 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -99.79 18.81 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 171.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 55.1 p-80 . . . . . 0 C--O 1.249 1.036 0 CA-C-N 114.163 -1.381 . . . . 0.0 112.387 -179.508 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.417 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 82.4 mtp . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -91.29 1.49 57.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.008 0.432 . . . . 0.0 110.733 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -96.88 -3.81 41.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.698 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.417 ' OD1' ' HB2' ' A' ' 1' ' ' MET . 18.2 m120 -70.29 -55.04 10.19 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.438 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -108.06 118.97 38.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.64 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -76.55 100.49 5.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.031 0.444 . . . . 0.0 110.788 -174.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -68.16 126.23 28.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.653 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -145.2 -165.11 11.04 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 111.574 -0.611 . . . . 0.0 111.574 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -70.47 117.4 11.96 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -53.43 -62.33 1.72 Allowed 'General case' 0 C--O 1.234 0.288 0 O-C-N 123.877 0.736 . . . . 0.0 110.965 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 m -79.18 105.97 10.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.57 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -72.12 113.49 9.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 0.0 109.952 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.494 ' HB2' ' HB3' ' A' ' 80' ' ' TRP . 61.5 mtm -86.78 164.36 16.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.594 -173.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -83.2 126.81 33.04 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.675 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.2 m -91.61 132.12 36.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.891 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.438 HD12 HG22 ' A' ' 32' ' ' THR . 0.2 OUTLIER -137.26 130.3 30.68 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.399 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.22 126.41 52.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.68 169.15 29.23 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.218 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.476 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 87.7 m-85 -103.25 135.51 44.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.849 0.357 . . . . 0.0 110.769 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.77 96.18 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.046 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.5 t -96.11 -53.32 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.608 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.85 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 92.8 mt -116.5 136.19 53.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.977 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -126.88 130.18 49.67 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.209 0.528 . . . . 0.0 111.01 -178.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.38 175.53 5.47 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -74.49 -34.33 63.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -119.23 -0.32 11.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.579 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -143.18 165.29 27.84 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 -175.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.429 ' HB3' ' CG2' ' A' ' 60' ' ' VAL . . . -138.89 122.31 17.21 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.859 0.362 . . . . 0.0 110.074 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.85 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 53.6 mt -90.9 99.33 9.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.243 0.544 . . . . 0.0 109.637 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.7 mt -108.94 139.08 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.711 -173.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.3 mt -87.67 114.21 26.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.438 HG22 HD12 ' A' ' 16' ' ' LEU . 6.0 p -80.08 -16.19 55.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.05 119.42 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' HE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -80.56 69.85 7.15 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -171.186 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -128.99 120.31 25.82 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 168.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -67.15 114.12 16.87 Favored Pre-proline 0 C--N 1.327 -0.377 0 O-C-N 123.109 0.256 . . . . 0.0 110.799 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 11.4 Cg_exo -70.92 156.99 59.34 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 123.016 2.477 . . . . 0.0 112.158 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.22 -178.09 34.46 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.769 178.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -58.25 -38.51 77.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.905 0.383 . . . . 0.0 110.746 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.6 mp0 -60.93 -40.44 93.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.474 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -72.92 -34.73 66.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.542 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -72.9 -20.08 61.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.613 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -82.1 -26.14 33.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.032 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.0 mt -61.96 145.17 53.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.5 m -88.32 -179.83 6.2 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.999 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.553 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 23.7 mp0 -54.24 -61.48 2.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.57 -172.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.23 -34.2 83.43 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.536 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.38 -41.26 89.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.838 0.352 . . . . 0.0 110.287 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.2 -33.36 65.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.657 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.564 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 66.1 mtt -64.4 -24.42 67.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.415 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -90.35 -31.5 16.87 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.5 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -78.37 -38.9 40.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.184 0.516 . . . . 0.0 110.261 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -113.59 55.39 0.72 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 50' ' ' MET . 20.8 tttt -61.38 112.67 2.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.469 -171.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 65.45 11.68 7.56 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.786 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -107.9 9.08 28.82 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.771 0.796 . . . . 0.0 109.199 174.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.562 HD11 HG22 ' A' ' 29' ' ' ILE . 18.8 tt -123.99 132.52 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.117 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.522 HG22 ' HB2' ' A' ' 90' ' ' PRO . 98.7 t -120.07 125.85 74.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.994 0.426 . . . . 0.0 110.981 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 HG12 ' A' ' 29' ' ' ILE . 56.4 mt -91.85 96.43 6.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.429 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.0 m -76.01 147.54 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.211 0.529 . . . . 0.0 110.704 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.87 119.87 6.14 Favored Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.769 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD13 HG21 ' A' ' 68' ' ' THR . 64.6 mt -89.1 27.08 1.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -38.25 80.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.371 -176.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.708 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 26.0 mm-40 -92.72 -9.38 40.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.687 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.422 HG22 HG23 ' A' ' 68' ' ' THR . 50.2 mt -117.36 104.64 16.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.044 0.449 . . . . 0.0 111.008 -175.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -82.23 -38.59 24.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.731 -178.115 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -81.01 47.99 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.446 0.641 . . . . 0.0 111.252 -175.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.531 HG21 HD13 ' A' ' 62' ' ' LEU . 2.2 p -85.36 18.39 2.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.573 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -73.99 -24.74 59.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.576 174.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.14 -26.33 65.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.928 174.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -83.42 121.48 27.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -119.29 165.53 14.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.903 0.382 . . . . 0.0 110.821 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -83.76 127.42 33.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.81 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.74 42.48 2.47 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.068 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -134.06 -171.15 2.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.177 0.513 . . . . 0.0 111.455 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 19' ' ' TYR . 83.6 tttt -138.69 129.52 26.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.107 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 pt -136.74 166.65 25.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.663 0.744 . . . . 0.0 112.586 -175.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HB2' HD11 ' A' ' 100' ' ' LEU . 55.8 tttt -122.56 106.98 11.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.309 177.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.527 ' HB ' HG21 ' A' ' 94' ' ' ILE . 30.1 m -98.41 149.34 5.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 120.988 0.423 . . . . 0.0 112.139 -171.406 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 13' ' ' MET . 5.6 m-90 -114.53 106.23 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.393 172.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.459 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.8 p90 -108.97 135.31 50.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.32 0.581 . . . . 0.0 111.106 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -91.61 -48.9 6.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.454 ' CG2' ' HB ' ' A' ' 93' ' ' THR . 8.6 t -104.68 126.64 51.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.281 0.562 . . . . 0.0 110.243 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -112.39 138.46 49.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.164 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.673 ' HB2' ' HB3' ' A' ' 91' ' ' SER . 58.9 mttm -118.04 134.28 55.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.0 0.428 . . . . 0.0 110.379 -178.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -110.02 56.5 0.62 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.485 0.659 . . . . 0.0 109.544 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 p -73.23 -23.36 60.35 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.53 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 63.87 99.78 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.629 0 C-N-CA 123.252 0.621 . . . . 0.0 111.293 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 34.0 Cg_endo -63.73 147.22 63.4 Favored 'Cis proline' 0 C--N 1.349 0.564 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.585 1.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 58' ' ' VAL . 34.8 Cg_exo -57.14 152.67 43.45 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.03 2.486 . . . . 0.0 113.082 -176.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB3' ' HB2' ' A' ' 85' ' ' LYS . 26.3 t -134.81 161.06 36.26 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.357 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.26 110.08 2.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.618 0.246 . . . . 0.0 110.599 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.454 ' HB ' ' CG2' ' A' ' 83' ' ' THR . 38.5 m -73.89 113.64 11.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.912 0.387 . . . . 0.0 110.09 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.527 HG21 ' HB ' ' A' ' 79' ' ' VAL . 31.8 pt -100.03 138.4 24.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.008 -177.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.708 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 39.7 mt-30 -104.85 -10.87 17.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.246 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -159.74 144.16 14.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.491 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.415 ' CD1' HD13 ' A' ' 65' ' ' ILE . 5.1 p90 -147.59 152.73 38.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.015 0.435 . . . . 0.0 111.12 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -114.56 144.17 43.81 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.092 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 51.2 tp -93.25 136.62 33.35 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 -178.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.6 mt -123.69 90.95 3.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.772 0.32 . . . . 0.0 110.182 178.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.01 147.67 29.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.932 0.396 . . . . 0.0 111.375 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.05 -43.62 98.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.401 177.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -99.42 114.97 28.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.158 -178.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -94.1 -17.07 23.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.763 -177.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -115.36 107.27 15.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -78.22 98.17 5.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.883 -172.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -98.0 -45.48 6.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.842 -1.169 . . . . 0.0 107.842 168.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 . . . . . 0 C--O 1.245 0.854 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.363 174.387 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.1 mtm . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 120.836 0.351 . . . . 0.0 110.394 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -87.53 122.5 31.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -83.47 -14.21 52.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.753 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -88.63 173.18 8.77 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.808 0.337 . . . . 0.0 110.277 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.24 131.4 34.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.001 0.429 . . . . 0.0 110.063 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -82.51 -36.29 26.56 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.607 -178.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.9 t30 50.67 44.25 27.61 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.926 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.8 161.68 39.7 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.521 -177.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -62.43 156.12 23.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.485 0.183 . . . . 0.0 110.615 -178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 65.49 43.28 3.44 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -171.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.9 m -63.1 112.09 2.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.195 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -75.99 111.51 11.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.725 175.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.46 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 67.5 mtm -85.38 150.78 24.5 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.644 -176.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -83.85 125.89 32.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.717 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.5 t -109.55 141.16 42.44 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.378 -173.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 78' ' ' LYS . 67.9 mt -139.41 146.82 40.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.276 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.7 t -97.08 127.96 48.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 171.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 157.47 27.31 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.819 -176.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.403 ' HE1' ' HE3' ' A' ' 76' ' ' LYS . 65.3 m-85 -94.66 125.51 39.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.465 -0.368 . . . . 0.0 110.308 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.51 104.73 11.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.47 HG11 HD21 ' A' ' 49' ' ' LEU . 7.1 p -100.66 -42.04 9.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.861 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 66.8 mt -129.34 154.81 46.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.644 0.259 . . . . 0.0 110.42 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -148.44 142.11 25.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.09 0.471 . . . . 0.0 111.171 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 13.8 t70 -123.14 -155.72 0.67 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 171.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.425 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 6.9 t30 -102.76 -31.3 10.39 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -91.66 -35.61 14.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.92 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -135.88 165.64 25.16 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.171 -174.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.37 149.69 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.751 174.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.747 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 42.0 mt -106.41 111.55 35.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.957 0.408 . . . . 0.0 110.488 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.76 141.94 44.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.462 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.3 mt -106.71 118.79 55.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.3 p -79.65 120.66 24.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.231 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 60.82 -162.43 0.27 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.665 0.603 . . . . 0.0 110.379 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m 76.94 14.26 2.06 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.314 174.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 62.96 -174.62 0.15 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.356 -178.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -84.09 135.42 42.12 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.292 178.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 32.2 Cg_exo -58.9 158.47 24.76 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.903 2.402 . . . . 0.0 112.452 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.5 174.08 55.15 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.266 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -62.07 -39.84 93.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.9 mp0 -65.05 -34.14 77.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.326 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -64.64 -36.6 84.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.698 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -75.57 -5.02 43.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.02 0.438 . . . . 0.0 111.042 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -109.16 -8.24 15.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.65 177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.1 mt -76.34 148.48 37.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 175.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -75.69 165.05 25.63 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.669 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -55.09 -47.45 74.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.537 -173.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.02 93.73 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.608 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.86 -44.82 96.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 0.0 110.624 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 21' ' ' VAL . 25.1 tp -62.78 -43.94 97.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.724 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.41 ' HG2' ' CD1' ' A' ' 57' ' ' ILE . 87.3 mtp -64.68 -22.98 67.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.428 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -93.49 -9.56 37.98 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.54 -50.7 5.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.998 0.427 . . . . 0.0 110.339 179.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -102.55 40.07 1.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -57.83 -29.78 65.21 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.897 -169.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -93.94 -23.76 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -109.41 11.42 25.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.745 0.307 . . . . 0.0 111.615 -175.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CD1' ' HG2' ' A' ' 50' ' ' MET . 10.7 tt -91.65 125.04 44.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.3 0.571 . . . . 0.0 110.722 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.0 t -118.84 120.43 64.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.942 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 66.1 mt -92.43 101.88 13.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.202 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -86.22 140.1 16.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.226 0.536 . . . . 0.0 111.236 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -92.17 125.89 8.28 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.292 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HG21 ' A' ' 68' ' ' THR . 63.2 mt -94.44 14.43 20.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.091 0.472 . . . . 0.0 110.531 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -60.08 -28.46 67.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.845 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 17.3 mm-40 -89.39 -3.44 58.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.442 -176.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' ASN . 26.5 mt -119.58 117.67 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.105 0.479 . . . . 0.0 110.249 -177.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -86.12 7.83 23.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.403 0.621 . . . . 0.0 111.136 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' ILE . 23.5 t-20 -153.94 83.77 1.15 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.168 -176.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.525 HG21 HD22 ' A' ' 62' ' ' LEU . 1.2 p -119.77 13.16 12.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.445 0.64 . . . . 0.0 110.614 177.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -72.98 -9.12 58.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.764 -175.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -92.68 5.86 49.51 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.081 -0.387 . . . . 0.0 111.049 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.7 tp -90.57 140.85 29.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.221 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.494 ' HD3' ' CD ' ' A' ' 75' ' ' GLU . 6.6 mptt -124.58 -178.52 4.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -93.17 123.23 36.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.052 174.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.61 42.69 2.11 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.556 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.494 ' CD ' ' HD3' ' A' ' 72' ' ' LYS . 53.9 mt-10 -128.3 177.84 6.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.896 0.379 . . . . 0.0 110.947 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.403 ' HE3' ' HE1' ' A' ' 19' ' ' TYR . 59.9 mttp -121.05 135.19 55.25 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.463 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.2 pt -137.62 152.99 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.334 0.588 . . . . 0.0 111.483 177.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 82.8 tttt -110.2 107.28 17.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.605 176.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.717 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.3 m -95.17 154.65 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -170.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.46 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 12.7 m-90 -125.78 123.38 38.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.636 172.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.554 ' HB3' HG22 ' A' ' 94' ' ' ILE . 55.5 p90 -140.07 171.35 14.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.003 0.43 . . . . 0.0 111.089 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 62.8 t60 -147.27 -35.8 0.23 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.494 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 2.5 m -76.47 98.78 4.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.063 175.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.0 ttt180 -94.73 120.95 35.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.406 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -119.8 139.35 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -121.57 101.62 7.72 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.464 -0.495 . . . . 0.0 110.864 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.5 t -104.8 -11.66 16.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.311 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 49.4 t-20 65.65 99.51 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 O-C-N 124.078 0.861 . . . . 0.0 109.675 -174.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 68.6 Cg_endo -72.28 171.4 63.33 Favored 'Cis proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.004 -1.248 . . . . 0.0 113.227 3.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.73 140.61 84.7 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.02 2.48 . . . . 0.0 112.798 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.8 p -130.04 115.75 17.56 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.417 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.4 125.05 50.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.764 0.316 . . . . 0.0 110.884 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 24.3 m -84.62 107.56 16.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.554 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.0 pt -96.44 139.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.113 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -103.14 -5.32 23.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.539 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -173.26 151.34 2.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.734 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -143.84 163.4 33.49 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.61 120.99 42.06 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.463 ' HA ' HG22 ' A' ' 77' ' ' ILE . 37.0 tp -75.24 109.71 8.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.961 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.614 HD22 ' HB2' ' A' ' 107' ' ' HIS . 43.5 mt -82.27 84.0 7.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.066 0.46 . . . . 0.0 110.533 -176.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.6 mt -63.67 132.14 50.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.688 175.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.51 28.49 0.47 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.161 0.505 . . . . 0.0 111.45 -170.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.68 -26.21 23.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -135.12 130.71 35.89 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 170.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -81.65 -8.83 59.75 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.785 0.326 . . . . 0.0 111.609 -169.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -127.75 110.46 12.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 110.044 174.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' HIS . . . . . 0.614 ' HB2' HD22 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -93.53 156.76 16.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.157 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 9.4 p80 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 177.666 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.432 ' HG2' ' OD1' ' A' ' 4' ' ' ASN . 57.6 ttp . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -98.91 -52.37 3.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.379 -175.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -71.33 -29.51 65.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.718 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.432 ' OD1' ' HG2' ' A' ' 1' ' ' MET . 88.7 m-20 64.82 14.53 9.25 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.477 0.485 . . . . 0.0 111.36 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 10.6 tp10 -98.97 145.97 26.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.328 -177.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -56.98 -48.44 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.857 -173.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -55.92 108.17 0.42 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.905 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.35 47.7 89.79 Favored Glycine 0 N--CA 1.449 -0.465 0 CA-C-N 115.621 -0.718 . . . . 0.0 113.347 174.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 5' ' ' GLU . 1.1 t70 -98.57 -162.75 0.98 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.99 -68.42 0.39 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.724 0.297 . . . . 0.0 111.64 -176.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.3 m -107.47 137.5 45.4 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.127 -176.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.05 116.52 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.532 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 53.1 mtp -107.83 119.02 38.26 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.885 0.374 . . . . 0.0 110.495 -177.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 13.4 mp0 -83.79 161.63 20.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.055 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 m -102.85 128.66 49.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 0.0 111.45 -175.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.617 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 4.7 tt -116.7 109.5 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.8 t -93.9 117.78 38.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 158.69 27.77 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.473 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -96.25 127.82 42.61 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.0 t -75.92 97.3 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -103.4 -37.5 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -176.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 29' ' ' ILE . 36.8 tp -136.26 126.69 26.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' HB2' ' A' ' 71' ' ' LEU . 62.4 tttm -146.46 125.54 12.88 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.664 -177.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -70.41 0.57 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.106 0.479 . . . . 0.0 110.245 176.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -154.68 -60.59 0.12 Allowed 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -97.61 -20.2 17.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.928 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 27' ' ' ARG . 19.8 mtm180 -104.13 123.88 48.08 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.967 0.413 . . . . 0.0 110.954 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.521 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -111.05 112.92 25.08 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.956 176.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.736 HD12 HD23 ' A' ' 22' ' ' LEU . 54.1 mt -86.03 109.46 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.473 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.22 143.01 42.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.688 -175.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.9 mt -104.97 123.0 58.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -76.78 101.23 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.548 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.3 t70 64.28 101.77 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.812 0.695 . . . . 0.0 111.364 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.15 -7.24 4.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.36 40.2 29.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -174.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.25 102.84 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.289 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.503 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -50.72 -63.52 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.186 2.591 . . . . 0.0 112.849 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.7 148.69 5.44 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.757 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -61.21 -37.71 83.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.477 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.8 -26.64 44.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.5 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 2.3 m-20 -65.41 -32.2 73.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.762 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -69.66 -14.19 62.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.918 0.389 . . . . 0.0 110.63 176.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -99.6 -18.07 17.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' HA ' ' A' ' 41' ' ' ASP . 87.6 mt -63.26 149.91 44.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.029 0.442 . . . . 0.0 110.989 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -76.25 171.26 14.83 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.871 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 50' ' ' MET . 41.9 tt0 -56.27 -54.62 43.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.346 -176.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.03 -37.5 91.67 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.469 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -65.28 -43.37 91.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.984 0.421 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.5 mt -68.23 -40.02 82.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.948 177.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 85.5 mtp -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.998 -177.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.59 -34.12 14.15 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.974 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -76.66 -43.9 36.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.057 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -110.09 39.82 2.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.871 0.844 . . . . 0.0 109.107 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' O ' HG22 ' A' ' 57' ' ' ILE . 26.7 ttpt -53.93 -48.64 70.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.723 -170.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -86.51 0.52 54.1 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -175.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -124.98 17.99 8.5 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.709 -176.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 89' ' ' PRO . 13.6 tt -103.36 124.14 57.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.193 0.521 . . . . 0.0 111.74 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.534 HG22 ' HG2' ' A' ' 90' ' ' PRO . 70.1 t -124.33 137.54 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.301 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.657 HD12 HG12 ' A' ' 29' ' ' ILE . 13.3 mm -104.2 100.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.142 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.418 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.3 m -89.01 139.95 16.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.257 0.551 . . . . 0.0 111.046 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -94.36 117.2 5.47 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.948 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 68' ' ' THR . 49.0 mt -95.75 11.03 34.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.626 0.37 . . . . 0.0 110.562 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.1 m -63.93 -14.83 56.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.441 ' OE2' ' HG2' ' A' ' 95' ' ' GLN . 27.5 tt0 -96.72 -3.33 42.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.21 0.529 . . . . 0.0 110.418 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.463 ' CG2' HG23 ' A' ' 68' ' ' THR . 31.1 mt -113.23 109.92 30.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.91 11.36 9.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.814 -168.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -136.9 24.01 3.07 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 122.207 -0.308 . . . . 0.0 111.763 -177.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.556 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.7 p -80.43 37.73 0.41 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.78 -21.22 25.24 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.046 0.451 . . . . 0.0 110.623 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -73.95 -17.73 60.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.976 -174.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.521 ' HB2' ' HE3' ' A' ' 23' ' ' LYS . 3.2 mm? -71.31 122.79 20.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.745 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -108.01 171.19 7.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.424 -179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -86.4 117.9 25.5 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.43 33.56 2.68 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.759 -177.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.63 -177.48 4.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -135.13 135.0 40.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 -175.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 99' ' ' LEU . 32.1 pt -137.93 151.45 25.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.432 0.634 . . . . 0.0 111.7 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.438 ' HB2' HD11 ' A' ' 100' ' ' LEU . 47.9 tttm -115.33 106.75 14.38 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.541 172.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.447 ' CG2' ' HB3' ' A' ' 16' ' ' LEU . 30.1 m -100.77 154.15 4.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.323 -174.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.532 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.2 m-90 -104.81 119.46 39.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.642 174.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.617 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -136.79 171.99 13.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -164.57 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.465 -0.789 . . . . 0.0 108.892 175.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 0.2 OUTLIER -75.3 90.68 2.63 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.991 174.506 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 84' ' ' ARG . 23.0 ttt180 -108.45 117.84 35.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.131 0.491 . . . . 0.0 110.787 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -112.47 94.51 4.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.399 -0.819 . . . . 0.0 108.839 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.767 ' HG3' ' HB3' ' A' ' 90' ' ' PRO . 27.3 tt0 -85.47 109.71 18.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.362 0.601 . . . . 0.0 111.283 -173.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p -108.68 -11.63 15.05 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.583 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.0 t30 62.01 96.18 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.354 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.433 -173.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.448 ' HB3' HG23 ' A' ' 57' ' ' ILE . 39.4 Cg_endo -66.63 144.1 66.91 Favored 'Cis proline' 0 C--N 1.344 0.317 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.677 1.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.767 ' HB3' ' HG3' ' A' ' 86' ' ' GLU . 41.4 Cg_endo -68.7 139.87 45.3 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.715 2.277 . . . . 0.0 112.656 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 29.8 t -111.28 153.45 25.9 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.21 131.18 19.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.682 0.277 . . . . 0.0 111.074 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 11.9 m -85.91 126.89 34.43 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.559 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.3 pt -117.47 153.04 19.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.519 -178.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HG2' ' OE2' ' A' ' 64' ' ' GLU . 80.0 mt-30 -110.6 -38.17 5.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.035 176.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -130.8 150.91 51.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.736 -172.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 1.7 p90 -152.07 154.1 35.27 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 0.0 110.712 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.411 ' OE2' ' HD3' ' A' ' 78' ' ' LYS . 42.0 mt-10 -117.21 114.34 23.51 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.502 175.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 77' ' ' ILE . 65.1 tp -71.38 104.41 3.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.438 HD11 ' HB2' ' A' ' 78' ' ' LYS . 73.1 mt -78.71 90.97 4.62 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.7 tp -66.49 93.33 0.23 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.965 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.41 ' OE1' ' HB2' ' A' ' 104' ' ' HIS . 2.6 tm-20 -57.34 116.76 3.51 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -80.25 21.08 0.62 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -166.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' HIS . . . . . 0.41 ' HB2' ' OE1' ' A' ' 102' ' ' GLU . 57.4 m80 -128.67 -58.54 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.334 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 22.0 m80 61.21 -166.4 0.21 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 -173.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.92 56.61 1.66 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.536 0.684 . . . . 0.0 110.024 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -145.48 7.83 1.15 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.065 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 65.1 t60 . . . . . 0 C--O 1.25 1.083 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.768 -172.542 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.583 0.23 . . . . 0.0 110.587 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 134.32 56.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.939 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 3' ' ' LYS . 11.0 mmtm -88.41 146.86 25.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.019 0.437 . . . . 0.0 110.886 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.588 ' OD1' ' HE3' ' A' ' 12' ' ' LYS . 33.8 t30 -117.05 127.05 53.78 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.788 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -93.39 -2.15 55.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.152 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -103.61 145.7 29.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.027 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -96.38 91.97 6.09 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 159.29 57.16 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 -175.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.23 -21.49 64.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.112 -0.544 . . . . 0.0 110.917 -174.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.05 -31.47 72.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.933 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -72.16 -19.94 61.68 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.348 0.594 . . . . 0.0 110.491 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.588 ' HE3' ' OD1' ' A' ' 4' ' ' ASN . 68.0 mttm -88.36 112.7 23.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.39 0.614 . . . . 0.0 110.652 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 69.3 mtp -111.21 140.33 45.86 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.135 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -83.84 119.56 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.321 -177.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.9 t -83.59 109.89 17.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 -178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD11 HG22 ' A' ' 32' ' ' THR . 3.2 tm? -116.52 119.31 35.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.693 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.444 HG22 ' HG3' ' A' ' 78' ' ' LYS . 30.5 t -94.08 129.65 44.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 162.8 28.93 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.656 -176.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.414 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 94.8 m-85 -100.89 126.46 47.51 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.71 91.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.705 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.494 HG23 ' CE1' ' A' ' 42' ' ' TYR . 2.9 p -93.15 -39.48 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.674 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.745 HD23 HD12 ' A' ' 29' ' ' ILE . 39.8 tp -130.27 133.01 46.18 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -131.37 137.47 48.74 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.827 0.346 . . . . 0.0 110.338 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.16 -176.98 3.24 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.22 -37.68 52.84 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -94.54 -37.31 11.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.782 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -137.56 174.75 10.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.983 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.419 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.89 149.24 33.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.511 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.745 HD12 HD23 ' A' ' 22' ' ' LEU . 42.3 mt -106.25 115.92 48.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.078 178.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.0 mt -110.09 138.48 46.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.404 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.8 mt -95.21 118.51 41.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.533 HG22 HD11 ' A' ' 16' ' ' LEU . 14.5 p -79.93 89.7 5.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.226 -174.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.414 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 38.5 t70 55.5 86.91 0.05 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.442 171.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -148.44 31.63 0.81 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.521 0.677 . . . . 0.0 110.064 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 63.91 28.05 14.5 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.269 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.44 150.9 0.11 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.67 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.483 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 95.3 Cg_endo -81.26 161.41 20.17 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.205 1.937 . . . . 0.0 111.559 173.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.86 173.29 30.52 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.145 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -58.78 -28.43 65.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.278 0.561 . . . . 0.0 109.714 177.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.59 -38.85 75.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.89 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 54.6 m-20 -81.17 -28.34 35.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.37 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . 0.494 ' CE1' HG23 ' A' ' 21' ' ' VAL . 91.7 m-85 -74.02 -18.88 60.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.129 0.49 . . . . 0.0 109.841 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -80.43 -37.21 32.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.177 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 78.8 mt -64.1 162.0 15.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.27 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.9 m -81.54 162.97 22.97 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -32.96 72.52 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.292 -173.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.78 -41.55 93.58 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.14 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.43 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 93.7 mt-30 -66.73 -38.01 85.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 110.193 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.8 tp -68.66 -40.66 80.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.008 175.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.542 ' HG3' HD13 ' A' ' 57' ' ' ILE . 47.9 ttm -61.54 -29.42 69.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -81.74 -35.14 30.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.97 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -71.98 -52.26 17.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.919 0.39 . . . . 0.0 110.683 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -95.35 46.39 1.11 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.515 0.674 . . . . 0.0 109.321 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.1 tttp -53.37 -35.08 59.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.362 -1.29 . . . . 0.0 113.247 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -109.04 1.31 20.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -120.71 7.16 10.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.608 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.542 HD13 ' HG3' ' A' ' 50' ' ' MET . 10.9 tt -93.43 123.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.968 -179.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.25 129.36 73.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.281 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.446 HG12 HG12 ' A' ' 29' ' ' ILE . 59.7 mt -95.57 108.2 20.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.834 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.77 142.98 12.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.262 0.553 . . . . 0.0 111.326 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.31 115.99 4.51 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.816 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.506 HD22 HG21 ' A' ' 68' ' ' THR . 69.8 mt -105.18 -4.8 21.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.735 0.303 . . . . 0.0 110.665 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.5 m -62.98 -29.21 70.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.321 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -90.65 9.56 29.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.121 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.448 HD12 HG13 ' A' ' 94' ' ' ILE . 58.2 mt -137.72 95.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 174.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -75.16 -9.66 58.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -176.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -89.81 33.5 0.85 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.641 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.506 HG21 HD22 ' A' ' 62' ' ' LEU . 8.0 p -101.93 21.17 15.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.131 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -80.6 -31.26 36.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.522 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -74.16 -10.57 59.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.583 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.4 tp -71.87 119.82 16.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.919 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -99.39 144.46 28.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.507 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -77.63 133.01 38.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.75 48.29 3.7 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -175.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HG2' HD11 ' A' ' 99' ' ' LEU . 6.0 tp10 -140.98 171.44 14.07 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -116.19 139.19 50.6 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.1 pt -139.36 154.68 25.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.27 0.557 . . . . 0.0 111.587 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.444 ' HG3' HG22 ' A' ' 17' ' ' VAL . 38.4 ttpt -116.58 107.0 14.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.168 -0.923 . . . . 0.0 108.899 174.13 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 25.3 m -96.85 158.96 3.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.042 0.449 . . . . 0.0 111.59 -173.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 3.3 m-90 -126.39 122.02 34.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.225 173.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -133.28 158.1 43.78 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.183 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -112.72 -12.19 13.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.06 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.9 m -141.11 137.18 32.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.165 -176.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.2 mtm-85 -112.38 140.48 47.06 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 174.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.787 ' HB3' ' HB2' ' A' ' 91' ' ' SER . 82.6 tttt -84.44 117.68 23.8 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 104.43 1.72 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.362 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.8 p -162.09 176.36 10.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.356 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 12.8 m120 -134.17 110.57 11.79 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.698 175.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 11.5 Cg_exo -71.36 156.25 96.84 Favored 'Cis proline' 0 C--O 1.235 0.368 0 C-N-CA 123.772 -1.345 . . . . 0.0 112.609 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.7 138.79 87.7 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.703 2.268 . . . . 0.0 112.149 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.787 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 21.6 m -112.54 158.32 20.08 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.273 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -150.79 101.38 2.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.887 0.375 . . . . 0.0 111.289 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 27.4 m -71.19 115.54 10.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 65' ' ' ILE . 37.7 pt -89.8 154.24 3.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.261 0.553 . . . . 0.0 111.736 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -104.76 -23.0 13.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.203 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 97' ' ' TYR . 51.6 tttt -162.32 159.56 25.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.318 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 30.2 p90 -148.89 157.67 43.6 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 175.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -114.48 116.25 28.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.74 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -72.48 108.76 5.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.937 179.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.7 mt -98.6 101.69 13.19 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 76.5 mt -61.58 119.73 9.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.867 -177.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.87 117.25 4.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.097 176.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -115.83 117.54 30.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.962 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.34 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.008 0.432 . . . . 0.0 109.951 175.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.25 98.28 5.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.941 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -86.6 -16.21 37.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.011 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -128.41 145.31 51.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.19 177.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.97 179.331 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.688 ' HG3' ' H ' ' A' ' 2' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.688 ' H ' ' HG3' ' A' ' 1' ' ' MET . 18.4 m120 -63.77 146.52 53.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.068 0.461 . . . . 0.0 110.647 -179.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -88.27 159.26 18.19 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.581 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -81.14 -33.39 33.21 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.592 ' HG2' ' H ' ' A' ' 7' ' ' ASN . 36.5 tt0 -80.19 140.63 36.23 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -83.37 -2.02 54.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.986 0.422 . . . . 0.0 110.812 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.592 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 79.9 m-20 -118.75 176.14 5.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.69 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 68.79 26.91 74.26 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.472 -177.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.06 -36.66 82.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.835 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -74.29 -29.0 61.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.865 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -61.62 108.07 0.92 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.118 -179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -111.54 115.14 28.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.401 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 61.3 mtm -128.96 146.66 50.91 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -87.14 116.77 25.43 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.634 ' HB3' ' CD1' ' A' ' 80' ' ' TRP . 17.8 p -94.15 133.85 37.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.728 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.402 HD12 HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -133.75 130.86 38.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.602 176.78 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -93.74 133.11 35.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.195 179.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -155.66 167.64 33.14 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.301 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -97.0 134.08 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.635 0.255 . . . . 0.0 110.776 178.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.2 t -83.64 106.36 14.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 25.5 m -104.34 -34.8 3.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.882 0.372 . . . . 0.0 111.552 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.724 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 84.8 mt -135.82 140.38 44.19 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -136.42 119.26 16.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.431 0.634 . . . . 0.0 111.901 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 18.7 t70 -97.54 176.33 5.9 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 170.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -64.21 -38.77 92.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.653 0.264 . . . . 0.0 110.453 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -107.65 -41.31 5.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.692 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 51.1 mtm-85 -104.2 115.8 31.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.108 0.48 . . . . 0.0 112.215 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.455 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -100.96 121.97 42.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.873 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.724 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 67.6 mt -91.3 110.83 22.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.011 -178.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 mt -109.87 147.34 33.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.749 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.6 mt -104.8 113.34 41.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.149 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HD12 ' A' ' 16' ' ' LEU . 10.2 p -90.65 -19.18 23.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.621 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 34.2 t70 -65.99 119.49 11.44 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 172.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.5 m -75.85 85.96 2.82 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.788 0.804 . . . . 0.0 112.07 -170.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -140.23 136.58 33.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.592 -1.186 . . . . 0.0 108.635 172.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -72.13 118.2 65.1 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 5.2 Cg_exo -78.81 115.61 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.603 2.202 . . . . 0.0 111.431 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 -163.66 25.18 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.774 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.36 -44.17 79.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.547 0.213 . . . . 0.0 111.206 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -67.78 -32.75 73.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.821 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -65.47 -36.76 84.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.125 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -85.72 -6.13 59.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -88.03 -26.49 22.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 110.319 176.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.33 147.54 47.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.212 177.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 57.3 p -75.67 161.53 29.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.348 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -53.17 -41.86 65.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.559 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.11 -53.15 48.1 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.491 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.91 -37.22 86.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.101 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.6 tp -61.23 -44.34 97.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.327 0.584 . . . . 0.0 109.849 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 51.9 ttm -70.86 -20.41 62.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.074 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -74.31 -38.63 63.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.197 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -79.61 -48.9 13.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.888 0.375 . . . . 0.0 110.94 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -91.27 23.67 3.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.837 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.409 ' HG2' HD21 ' A' ' 88' ' ' ASN . 84.3 tttt -50.16 -42.26 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -171.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -98.45 12.1 36.1 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 16.0 t-20 -154.49 34.44 0.41 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.322 0.582 . . . . 0.0 111.19 -177.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.6 tt -119.8 132.43 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.5 t -121.47 125.35 73.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 0.0 111.391 -174.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.8 mt -101.35 114.87 41.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 27.1 m -98.89 145.16 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.187 0.518 . . . . 0.0 111.373 -176.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -95.14 114.22 4.8 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.045 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 68' ' ' THR . 42.4 mt -87.06 4.77 40.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.048 0.451 . . . . 0.0 109.914 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -56.84 -37.24 70.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.51 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -85.23 -7.21 59.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 0.0 110.997 -178.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.9 mt -94.53 -39.24 10.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.681 176.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 76.08 -37.98 0.32 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.351 172.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -130.27 87.83 2.56 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.385 0.612 . . . . 0.0 109.658 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.538 ' HB ' HD13 ' A' ' 62' ' ' LEU . 4.0 m -119.62 24.58 10.54 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 174.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -18.36 52.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.541 -1.663 . . . . 0.0 113.202 -172.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -66.67 -27.5 67.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.922 0.391 . . . . 0.0 110.606 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 77' ' ' ILE . 3.6 mp -73.81 145.29 45.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.342 0.591 . . . . 0.0 111.8 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -119.47 157.88 27.38 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.197 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.437 ' O ' ' HG3' ' A' ' 73' ' ' ARG . 7.9 ptt180 -76.94 71.7 3.46 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.105 0.955 . . . . 0.0 110.768 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 162.48 48.7 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -138.06 -173.88 3.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.187 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -126.98 124.75 40.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.757 -176.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.622 HG21 HD21 ' A' ' 71' ' ' LEU . 42.8 pt -136.34 166.85 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.644 0.735 . . . . 0.0 112.43 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -131.31 106.94 8.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.46 -1.245 . . . . 0.0 108.562 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.4 m -95.86 150.73 4.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.634 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 5.4 m-90 -116.11 118.31 32.5 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.736 173.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.539 ' HB3' HG22 ' A' ' 94' ' ' ILE . 19.0 p90 -124.77 176.62 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.105 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -93.71 -43.14 8.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.927 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -162.76 177.85 8.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.456 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -123.68 136.0 54.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.914 0.388 . . . . 0.0 111.0 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -99.13 97.65 8.74 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HG2' ' HG3' ' A' ' 90' ' ' PRO . 1.5 tm-20 -87.36 87.89 7.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.256 0.551 . . . . 0.0 110.141 -174.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.5 p -108.02 2.89 23.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.251 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 27.1 t-20 60.18 101.11 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.364 -177.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 73.9 Cg_endo -75.98 152.38 96.6 Favored 'Cis proline' 0 CA--C 1.53 0.325 0 C-N-CA 123.29 -1.546 . . . . 0.0 112.658 -0.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.509 ' HG3' ' HG2' ' A' ' 86' ' ' GLU . 31.9 Cg_exo -59.09 120.54 8.46 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.646 2.231 . . . . 0.0 112.003 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.6 m -105.69 142.69 34.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.635 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -142.37 121.79 13.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.85 0.357 . . . . 0.0 111.443 -177.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.6 m -81.49 110.05 16.53 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.539 HG22 ' HB3' ' A' ' 81' ' ' PHE . 37.8 pt -96.43 155.49 3.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.608 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.35 -29.43 5.5 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.464 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -135.03 155.17 51.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.885 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -153.7 148.1 26.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.178 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.458 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 34.3 tt0 -114.69 119.71 37.65 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 53.6 tp -78.6 119.5 21.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.504 -177.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 98.1 mt -103.65 80.86 1.83 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.132 0.491 . . . . 0.0 110.367 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.9 tp -72.8 128.3 35.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.375 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -35.58 80.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.097 0.475 . . . . 0.0 110.696 -175.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.72 81.43 8.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.243 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -77.21 71.0 3.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.965 0.412 . . . . 0.0 110.027 177.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 57.8 m170 -120.03 -44.62 2.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.604 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -83.6 66.03 8.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.727 0.775 . . . . 0.0 111.868 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -114.66 8.57 16.28 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 162.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 32.1 m80 . . . . . 0 C--O 1.247 0.949 0 CA-C-N 113.504 -1.68 . . . . 0.0 108.136 -178.686 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.7 mtt . . . . . 0 N--CA 1.484 1.254 0 CA-C-O 121.111 0.481 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -114.52 -165.68 1.04 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -87.13 -15.42 38.47 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.349 0.595 . . . . 0.0 110.372 176.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -125.01 106.36 9.89 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 174.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -91.22 160.15 15.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.791 0.805 . . . . 0.0 112.493 -170.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -92.77 102.91 15.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.225 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -65.98 151.73 46.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.09 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -82.41 56.57 5.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.676 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -167.23 149.04 5.87 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.74 -28.78 60.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.841 0.353 . . . . 0.0 110.777 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.4 p -87.85 -170.1 2.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 63.8 29.66 14.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.368 0.604 . . . . 0.0 109.892 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.462 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 75.6 mtm -76.72 143.37 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.04 175.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -83.63 116.78 22.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -175.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.566 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 10.8 t -107.94 139.5 42.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.013 -169.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.431 HD12 ' C ' ' A' ' 15' ' ' SER . 6.0 mp -138.47 163.32 32.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.298 174.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -95.71 140.42 17.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 136.84 6.09 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.055 -1.069 . . . . 0.0 112.468 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -90.25 124.47 34.9 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.966 0.412 . . . . 0.0 110.115 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.9 t -82.01 104.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.983 -177.269 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 HD21 ' A' ' 49' ' ' LEU . 15.9 m -100.98 -41.28 8.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.177 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.705 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.1 mt -130.23 146.1 51.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 110.515 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -132.85 123.54 26.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.314 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 67.6 m-20 -101.33 -2.91 29.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 174.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 t30 75.63 -55.59 0.62 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.478 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.71 -18.91 50.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.599 0.714 . . . . 0.0 109.186 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 14.7 mtm180 -135.16 159.74 40.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.802 175.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.75 127.61 31.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.055 0.455 . . . . 0.0 110.518 175.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.705 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 56.9 mt -95.4 101.53 12.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.456 HD22 HG22 ' A' ' 20' ' ' VAL . 32.4 mt -115.05 140.91 48.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.124 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -90.67 111.47 23.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -83.2 -9.34 59.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.306 0.574 . . . . 0.0 110.979 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -90.38 157.58 17.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.324 176.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.9 p -89.53 3.44 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -172.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.42 93.92 4.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 109.898 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.97 128.1 92.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.435 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 96.3 Cg_endo -78.94 -178.93 5.01 Favored 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 123.008 2.472 . . . . 0.0 112.671 -178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.66 -176.37 20.62 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.521 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -68.38 -23.12 64.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.968 0.414 . . . . 0.0 110.637 -177.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 27.3 mp0 -70.81 -38.41 73.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.377 177.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 7.8 m-20 -65.17 -38.54 90.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.491 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -65.94 -19.03 65.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.889 0.376 . . . . 0.0 111.018 175.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -89.43 -20.48 23.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.939 178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 99.2 mt -74.76 153.37 38.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 177.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.2 p -77.68 168.68 19.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.52 ' HG3' HD13 ' A' ' 22' ' ' LEU . 1.6 mp0 -53.77 -42.65 68.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.77 178.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.53 -49.33 70.24 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.222 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 77.9 mm-40 -64.11 -43.52 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.928 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.519 HD21 HG21 ' A' ' 21' ' ' VAL . 29.1 tp -64.31 -47.23 80.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.245 -177.311 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.458 ' SD ' HD11 ' A' ' 59' ' ' ILE . 68.3 mtm -75.82 -13.36 60.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.484 -177.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -89.07 -35.44 16.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.086 0.47 . . . . 0.0 110.295 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -73.38 -49.22 28.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.349 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.58 47.12 0.93 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -59.12 121.02 10.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.794 -172.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 69.35 4.83 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.041 -0.981 . . . . 0.0 112.358 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -104.83 5.59 33.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.585 0.707 . . . . 0.0 109.281 173.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.611 HD11 HG22 ' A' ' 29' ' ' ILE . 19.4 tt -126.04 140.14 49.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.697 -176.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -122.53 129.07 75.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.124 0.488 . . . . 0.0 111.086 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.458 HD11 ' SD ' ' A' ' 50' ' ' MET . 60.4 mt -94.91 107.76 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 175.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.484 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.5 m -88.91 145.2 7.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.255 0.55 . . . . 0.0 111.032 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.13 115.19 4.53 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.346 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 28' ' ' ALA . 87.2 mt -94.98 21.48 7.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.005 0.431 . . . . 0.0 110.307 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 27.2 p -60.6 -25.79 66.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.333 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -87.45 -9.31 54.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.011 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.439 HD11 ' HA ' ' A' ' 96' ' ' LYS . 47.7 mt -128.32 105.59 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.23 -177.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -81.66 -11.85 58.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.707 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -116.04 82.07 1.71 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.547 0.689 . . . . 0.0 109.813 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.588 HG21 HD13 ' A' ' 62' ' ' LEU . 38.4 p -111.14 17.68 20.11 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.219 -0.901 . . . . 0.0 108.606 174.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.88 -27.32 69.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.341 -1.3 . . . . 0.0 111.306 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.73 -23.48 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.065 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 23.9 tp -65.19 131.7 47.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -117.76 172.8 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.228 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 73' ' ' ARG . 23.8 mtm180 -98.0 137.56 36.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.809 0.338 . . . . 0.0 110.31 176.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.33 23.33 22.19 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -116.97 -173.12 2.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.075 0.464 . . . . 0.0 111.404 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HG2' HD12 ' A' ' 100' ' ' LEU . 78.3 tttt -141.82 123.21 14.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.972 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 pt -130.98 168.9 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.388 0.613 . . . . 0.0 112.004 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -116.48 117.84 31.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.08 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.566 ' O ' ' HA ' ' A' ' 15' ' ' SER . 26.8 m -104.29 148.69 8.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.511 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 6.8 m-90 -125.67 116.76 22.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.148 175.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.59 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.1 p90 -126.05 167.6 15.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 0.0 111.886 177.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.71 29.66 2.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.075 177.028 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -172.29 148.22 2.08 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.617 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -149.5 139.39 21.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -113.43 141.67 46.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.141 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.25 47.47 1.34 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.852 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.9 p -64.85 -37.82 88.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 55.57 93.95 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 O-C-N 123.875 0.735 . . . . 0.0 111.764 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 38.7 Cg_exo -60.98 135.38 14.62 Favored 'Cis proline' 0 C--N 1.354 0.824 0 C-N-CA 124.163 -1.182 . . . . 0.0 112.788 3.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 36.9 Cg_exo -59.43 141.45 97.53 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.125 2.55 . . . . 0.0 113.009 -175.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.0 p -116.22 151.09 36.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.89 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.34 119.15 9.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.741 0.305 . . . . 0.0 110.808 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 45.6 m -78.55 110.72 13.9 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.366 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.59 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.1 pt -96.13 143.76 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.659 -178.14 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -93.07 -28.81 16.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.615 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.439 ' HA ' HD11 ' A' ' 65' ' ' ILE . 67.8 mttm -150.89 159.58 44.46 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.339 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -147.65 147.6 30.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.595 176.484 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.511 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 28.0 tt0 -114.42 136.88 52.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.185 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.31 120.83 25.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.506 HD12 ' HG2' ' A' ' 76' ' ' LYS . 92.9 mt -89.6 118.46 29.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.047 0.451 . . . . 0.0 110.209 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.83 84.23 6.94 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.344 -178.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.52 108.43 4.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.106 178.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -76.25 -34.12 59.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -141.7 107.74 5.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.051 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -63.32 117.35 6.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -78.93 100.62 7.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.94 -173.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -80.73 128.45 33.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.11 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 31.7 m170 . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.824 176.897 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.483 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 93.5 m-20 -86.36 121.97 29.67 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 175.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -53.16 -53.53 49.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.269 -174.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . 0.418 ' ND2' ' HB2' ' A' ' 6' ' ' GLN . 43.5 t30 -85.83 118.16 25.15 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.96 -31.11 64.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.426 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.418 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 96.0 mt-30 -62.95 -27.82 69.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.708 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -102.48 -4.14 25.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.442 0.639 . . . . 0.0 109.704 177.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.483 ' HA2' ' HB2' ' A' ' 2' ' ' ASN . . . -74.45 178.92 44.11 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.689 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -92.76 139.9 30.07 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.897 0.38 . . . . 0.0 110.646 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -107.3 -71.46 0.75 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 175.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 m -84.82 103.92 14.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.61 116.57 8.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.077 0.465 . . . . 0.0 111.399 -176.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.1 mtp -92.2 124.11 36.04 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.6 mt-30 -83.66 125.27 31.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.173 0.511 . . . . 0.0 110.442 -171.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.2 m -100.81 134.47 43.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.809 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.51 HD12 ' CE2' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -117.75 124.37 48.3 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 174.297 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.1 t -94.52 117.87 39.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.87 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.61 167.37 29.21 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.85 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.44 146.14 26.66 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.9 t -101.23 108.44 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.463 HG22 ' HG2' ' A' ' 37' ' ' PRO . 47.0 t -101.17 -59.66 3.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.856 0.36 . . . . 0.0 110.821 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.701 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 85.6 mt -116.65 159.51 22.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.405 -175.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -143.95 124.22 13.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.621 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 8.1 t70 -77.92 -66.4 0.85 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.124 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 49.3 t30 163.72 -60.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.662 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -90.62 -17.09 27.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.827 -1.078 . . . . 0.0 109.68 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -124.77 151.07 45.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.493 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.532 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -122.73 138.61 54.57 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.17 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.701 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 73.3 mt -99.05 104.08 15.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.913 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.8 mt -112.63 156.44 22.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.712 -172.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -106.39 109.0 26.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.229 171.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.0 p -83.84 72.55 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.8 0.809 . . . . 0.0 109.763 177.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -157.34 -167.36 2.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.606 -175.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -110.63 -11.98 14.38 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.952 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.68 132.43 46.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.057 0.456 . . . . 0.0 111.652 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -99.37 115.87 65.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.265 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HG2' HG22 ' A' ' 21' ' ' VAL . 18.1 Cg_exo -66.63 146.17 78.36 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.819 2.346 . . . . 0.0 112.169 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.77 -179.36 31.98 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.667 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.51 -40.07 81.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.849 0.357 . . . . 0.0 110.864 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.543 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.8 tt0 -64.3 -31.57 72.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -72.03 -35.03 69.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.833 0.349 . . . . 0.0 110.363 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.73 -25.07 61.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.063 0.459 . . . . 0.0 109.896 174.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -75.37 -27.91 59.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.139 176.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 95.7 mt -65.96 155.84 35.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.247 176.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.8 p -90.53 174.07 7.73 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.411 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.81 -50.96 55.16 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 123.41 0.444 . . . . 0.0 111.821 -176.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.62 -42.5 99.69 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.619 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -65.71 -39.1 90.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 0.0 110.254 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.31 -44.68 94.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.145 176.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.667 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 76.2 mtp -67.84 -18.35 64.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.967 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -91.56 -21.36 20.89 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.745 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -86.12 -51.32 6.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.328 0.585 . . . . 0.0 109.733 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -96.23 49.64 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' MET . 33.6 tttp -53.65 118.21 3.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.522 -170.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 64.89 10.34 6.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.584 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -106.31 15.26 26.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.753 0.787 . . . . 0.0 109.278 175.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.569 HD11 HG23 ' A' ' 29' ' ' ILE . 8.8 tt -107.97 135.53 46.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.335 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.536 HG22 ' HB2' ' A' ' 90' ' ' PRO . 74.6 t -126.76 131.66 70.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.854 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 72.2 mt -97.24 109.14 22.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 175.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.0 m -93.09 140.99 15.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.295 0.569 . . . . 0.0 111.318 -177.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.63 118.65 5.29 Favored Glycine 0 N--CA 1.442 -0.965 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.36 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.658 HD13 HG21 ' A' ' 68' ' ' THR . 11.0 mt -99.26 17.78 19.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.3 p -65.59 -14.23 60.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.685 -176.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -86.45 -12.45 49.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.004 0.43 . . . . 0.0 110.325 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.479 HG22 ' H ' ' A' ' 67' ' ' ASN . 30.5 mm -117.65 108.8 25.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.893 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -91.98 16.53 10.92 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.468 0.651 . . . . 0.0 110.004 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . 0.479 ' H ' HG22 ' A' ' 65' ' ' ILE . 95.2 m-20 -134.22 31.44 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.019 -176.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.658 HG21 HD13 ' A' ' 62' ' ' LEU . 1.7 m -86.45 44.13 1.12 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.378 0.609 . . . . 0.0 111.861 -171.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.57 -23.54 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.543 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -83.58 5.59 23.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.105 0.479 . . . . 0.0 111.074 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 97' ' ' TYR . 9.9 tt -97.52 115.82 28.55 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -100.18 -172.36 2.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.399 0.618 . . . . 0.0 111.354 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -96.82 141.52 29.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.19 168.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.45 31.27 28.04 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.818 176.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -119.08 -168.01 1.49 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.932 0.396 . . . . 0.0 110.419 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -138.38 134.59 34.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.7 pt -135.63 158.33 39.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 112.421 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -117.64 106.77 13.45 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.932 173.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 19.1 m -100.65 148.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.95 0.405 . . . . 0.0 111.866 -172.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.509 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 7.9 m-90 -106.23 104.92 14.72 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.331 173.381 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.513 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -107.21 159.08 16.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.057 -177.456 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -112.38 -30.97 6.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.771 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -134.57 127.17 30.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.973 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -119.25 123.61 44.69 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 174.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -125.1 121.03 33.09 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.621 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.79 83.6 7.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.939 0.4 . . . . 0.0 110.313 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -84.24 -13.77 51.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.833 175.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 66.2 t30 58.12 92.72 0.06 OUTLIER Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.151 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 15.0 Cg_exo -67.96 143.64 69.78 Favored 'Cis proline' 0 C--N 1.346 0.421 0 C-N-CA 123.836 -1.318 . . . . 0.0 112.768 2.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' A' ' 58' ' ' VAL . 31.7 Cg_exo -58.22 142.7 97.47 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.715 2.277 . . . . 0.0 112.327 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 15.5 m -122.82 156.63 34.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.637 179.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.533 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -146.47 136.36 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.558 0.218 . . . . 0.0 110.879 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.5 m -94.41 114.7 26.77 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.513 HG22 ' HB3' ' A' ' 81' ' ' PHE . 2.8 pp -104.11 142.0 18.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.782 -177.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -105.22 -9.56 17.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.753 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.27 147.6 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.461 ' CE2' HD12 ' A' ' 71' ' ' LEU . 4.7 p90 -134.07 146.67 50.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 0.0 110.703 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.509 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 33.2 tt0 -116.24 126.45 53.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.812 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 39.6 tp -75.97 135.92 40.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.31 0.576 . . . . 0.0 111.4 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 58.3 mt -112.72 105.67 13.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.2 mt -60.03 -30.15 68.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.726 -174.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.402 ' HG2' ' ND1' ' A' ' 103' ' ' HIS . 43.7 tt0 -141.83 -78.74 0.25 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 175.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' HIS . . . . . 0.402 ' ND1' ' HG2' ' A' ' 102' ' ' GLU . 34.1 p-80 -171.73 160.77 5.78 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 27.8 m80 -114.13 96.0 5.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.144 0.497 . . . . 0.0 110.295 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -91.52 120.2 32.13 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.499 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -106.2 160.06 15.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.268 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -111.89 179.82 3.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 42.2 m80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.056 179.546 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtm . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 67.37 176.06 0.25 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 122.067 0.937 . . . . 0.0 113.158 171.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -175.76 -53.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.775 -1.557 . . . . 0.0 106.972 173.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -89.87 135.28 33.73 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.569 165.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 45.1 mm-40 -54.86 -43.61 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -84.58 15.58 3.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.948 0.404 . . . . 0.0 111.743 -173.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -113.4 20.13 16.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.293 0.568 . . . . 0.0 110.025 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 177.5 54.52 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.955 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 5' ' ' GLU . 5.7 t70 -172.15 -37.0 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.656 0.741 . . . . 0.0 109.31 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 71.82 17.3 5.4 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.793 168.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -81.07 113.12 19.05 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 170.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -99.21 153.5 18.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.095 0.474 . . . . 0.0 110.727 -178.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.511 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 76.7 mtm -109.74 151.0 27.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.372 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -88.56 139.11 30.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.577 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.6 t -88.88 124.5 34.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.963 0.411 . . . . 0.0 110.887 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.36 125.49 42.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.869 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 60.7 t -105.33 120.9 56.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 174.47 28.26 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.432 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -102.07 136.62 41.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.472 HG22 HD22 ' A' ' 30' ' ' LEU . 11.4 t -91.6 102.7 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.725 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.41 HG23 ' HG ' ' A' ' 22' ' ' LEU . 17.2 m -100.21 -35.58 4.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.499 -178.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.898 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 70.1 mt -129.72 138.52 51.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -176.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -148.73 127.92 12.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.8 175.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.26 -80.68 0.53 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.773 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -144.4 -66.57 0.34 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -89.94 -18.76 25.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.135 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -119.97 140.21 51.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.492 0.663 . . . . 0.0 112.048 -172.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.577 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.62 117.74 27.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.156 172.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.898 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 47.5 mt -88.63 105.91 16.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.752 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.472 HD22 HG22 ' A' ' 20' ' ' VAL . 20.8 mt -106.42 157.61 17.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.966 -176.163 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.9 mt -103.48 120.55 53.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -31.81 68.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.195 0.521 . . . . 0.0 110.787 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.54 130.31 35.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.194 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.2 p -75.94 79.06 2.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.421 0.629 . . . . 0.0 111.169 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -144.95 144.85 31.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.199 -176.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.74 119.58 69.46 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 50.1 Cg_exo -54.77 -71.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.906 2.404 . . . . 0.0 112.822 -175.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.43 166.72 14.51 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.433 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.07 -41.2 97.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.957 0.408 . . . . 0.0 110.358 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.69 -37.1 81.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.509 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.62 -34.82 77.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.389 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -73.84 -12.07 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.48 177.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -93.15 -23.82 18.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.023 0.44 . . . . 0.0 110.221 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.9 mt -70.51 152.9 43.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.882 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -71.62 155.78 40.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.201 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HG3' HD22 ' A' ' 22' ' ' LEU . 1.8 mp0 -51.14 -49.68 60.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.363 0.414 . . . . 0.0 111.118 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.09 81.39 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.936 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.43 -38.94 74.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.021 0.439 . . . . 0.0 110.232 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.69 -38.33 80.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.175 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.433 ' HE3' ' HG3' ' A' ' 89' ' ' PRO . 82.8 mtp -63.41 -33.48 75.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.634 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -70.11 -38.31 75.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.812 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.82 -52.25 18.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.857 -177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -96.1 37.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.837 0.351 . . . . 0.0 110.579 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -43.44 -49.51 7.14 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -172.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -108.58 8.38 27.11 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.22 16.22 13.16 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.838 0.351 . . . . 0.0 110.227 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.432 ' O ' ' HD2' ' A' ' 90' ' ' PRO . 8.0 tt -126.42 146.54 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.322 -174.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HB2' ' A' ' 90' ' ' PRO . 59.5 t -134.53 120.8 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.054 0.454 . . . . 0.0 110.446 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.1 mt -89.79 105.47 16.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.707 177.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 92' ' ' ALA . 33.8 m -87.25 146.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.354 0.597 . . . . 0.0 111.271 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -91.4 117.69 5.25 Favored Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.816 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 28' ' ' ALA . 85.9 mt -95.1 7.26 46.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.764 0.426 . . . . 0.0 110.009 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 p -57.75 -30.61 65.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.712 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -73.45 -35.17 65.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.494 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' 96' ' ' LYS . 36.1 mt -104.76 99.23 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.28 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.37 -21.01 63.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.538 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -97.57 37.43 1.37 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.514 0.674 . . . . 0.0 110.885 -176.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.528 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.0 OUTLIER -83.39 16.28 2.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.929 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -67.23 -20.48 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.201 0.524 . . . . 0.0 110.455 178.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.96 -21.09 65.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.628 178.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 77' ' ' ILE . 13.3 tp -76.91 144.49 38.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.318 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -132.5 -172.47 2.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.402 -174.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 73' ' ' ARG . 19.0 mtp180 -100.86 129.57 46.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 173.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.41 33.82 6.99 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.053 -0.594 . . . . 0.0 111.879 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.56 163.45 12.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.014 0.435 . . . . 0.0 111.296 -175.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -120.7 112.62 19.09 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 170.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 71' ' ' LEU . 42.0 pt -125.16 151.88 31.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.453 0.644 . . . . 0.0 111.899 -176.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.422 ' HE3' ' CH2' ' A' ' 80' ' ' TRP . 35.8 ttpt -107.99 107.42 18.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.881 175.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 34.3 m -100.25 157.98 3.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.016 0.436 . . . . 0.0 111.472 -174.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.511 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 11.0 m-90 -124.62 129.64 50.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.047 175.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 4.4 p90 -151.09 161.82 42.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.585 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -128.49 -35.67 1.93 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.1 m -93.88 106.24 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.649 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -103.87 133.31 49.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.396 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -112.69 93.87 4.64 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.534 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 43.2 tt0 -92.77 89.61 6.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.219 0.533 . . . . 0.0 110.218 -177.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -103.23 -3.65 25.41 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.267 -175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 63.43 97.3 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.435 0 O-C-N 123.755 0.66 . . . . 0.0 110.535 -175.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 57.1 Cg_endo -70.28 150.18 91.03 Favored 'Cis proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.533 -1.445 . . . . 0.0 112.897 1.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.534 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.0 Cg_exo -61.13 146.3 97.76 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.024 2.483 . . . . 0.0 112.633 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.7 m -132.29 157.92 43.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.929 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.44 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -147.2 122.27 10.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.602 0.239 . . . . 0.0 111.224 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.4 m -84.23 110.56 18.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.5 pt -101.24 141.52 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.264 -174.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HB2' ' SD ' ' A' ' 13' ' ' MET . 95.7 mt-30 -96.75 -21.29 17.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.627 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.54 ' HA ' HD11 ' A' ' 65' ' ' ILE . 57.8 tttm -158.31 146.02 18.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.539 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 24.8 p90 -128.0 174.71 8.96 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.497 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -143.59 118.71 10.1 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.4 tp -73.46 127.8 33.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.481 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.2 mt -100.48 139.95 35.43 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.2 mt -79.63 13.67 1.97 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.023 0.44 . . . . 0.0 111.497 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -85.57 64.92 8.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.874 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -82.52 -57.4 3.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.493 0.663 . . . . 0.0 109.277 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -93.57 96.38 9.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.272 177.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -72.78 158.05 36.31 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.405 -175.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -118.2 136.82 53.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.056 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 t-160 -77.11 -32.77 56.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.571 176.216 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.904 0.383 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -84.53 -32.15 24.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.807 177.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -94.76 -165.04 1.24 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.563 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -104.31 -17.15 14.94 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -173.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' A' ' 5' ' ' GLU . 2.4 mp0 -65.62 107.18 1.65 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -79.14 98.79 6.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.23 0.538 . . . . 0.0 110.27 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -119.76 162.17 19.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.768 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.67 -143.79 3.58 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.215 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -130.91 136.4 48.57 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.32 -34.83 79.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.166 0.508 . . . . 0.0 110.377 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.6 m -79.14 94.38 5.36 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -72.24 104.52 3.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.583 177.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 71.2 mtp -87.62 107.52 18.65 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.999 -174.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -100.63 125.49 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.619 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 60.0 p -92.52 149.56 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.283 0.564 . . . . 0.0 112.0 -174.485 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -146.74 131.47 17.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.181 175.507 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.4 t -98.18 126.32 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 158.79 27.8 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.416 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.411 ' HE1' ' HA ' ' A' ' 34' ' ' THR . 97.6 m-85 -84.8 124.2 31.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.434 ' HA ' HD22 ' A' ' 30' ' ' LEU . 15.0 t -81.68 107.95 14.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.502 HG11 ' HG2' ' A' ' 37' ' ' PRO . 27.1 m -114.99 -41.29 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.737 0.303 . . . . 0.0 111.665 -176.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.739 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 71.7 mt -120.94 144.72 48.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 68' ' ' THR . 48.4 tttm -148.36 132.04 16.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 0.0 111.65 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -111.82 -165.19 0.97 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 169.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -90.19 -25.92 20.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.426 0.631 . . . . 0.0 109.542 174.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -94.15 -32.48 13.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.645 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -143.9 161.48 38.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 0.0 111.048 -171.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.554 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.63 127.35 31.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.711 173.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.739 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 37.6 mt -93.83 111.21 24.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -177.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 20' ' ' VAL . 23.8 mt -112.42 148.96 33.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.689 -174.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.2 mt -98.49 119.29 46.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 174.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 p -85.76 -14.37 45.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.141 0.495 . . . . 0.0 110.793 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -75.7 163.15 27.59 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.411 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.5 p -89.48 -11.85 41.76 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -76.69 105.58 7.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 0.0 110.695 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.98 137.58 61.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.209 176.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HG2' HG11 ' A' ' 21' ' ' VAL . 24.1 Cg_exo -63.61 151.5 84.77 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.087 2.524 . . . . 0.0 112.62 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.98 -175.62 39.49 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.932 177.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -51.75 -53.34 40.76 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.831 0.453 . . . . 0.0 111.621 -178.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 4.2 mp0 -67.97 -26.82 66.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.342 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -69.89 -35.23 74.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.678 0.275 . . . . 0.0 110.775 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -72.37 -18.44 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.962 0.41 . . . . 0.0 110.526 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.05 -22.09 25.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 98.9 mt -63.9 151.53 42.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.4 p -75.23 163.13 27.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.976 0.417 . . . . 0.0 111.109 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' A' ' 50' ' ' MET . 41.2 tt0 -53.35 -45.64 69.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.319 -177.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.88 -47.0 93.41 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.577 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -61.57 -40.21 93.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.682 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.48 -43.27 97.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.389 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.409 ' HE3' ' HG2' ' A' ' 46' ' ' GLU . 66.0 mtt -66.64 -24.65 66.33 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.239 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -85.76 -35.91 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.274 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -73.04 -37.67 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.911 0.386 . . . . 0.0 110.652 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -107.68 39.2 1.97 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.229 0.538 . . . . 0.0 109.906 176.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -52.85 121.72 7.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.936 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.5 t30 73.84 -7.47 1.59 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.844 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 85.4 m-20 -109.48 15.81 22.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.572 0.701 . . . . 0.0 110.106 178.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 21.0 tt -126.63 130.2 71.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.016 179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.507 HG22 ' HG2' ' A' ' 90' ' ' PRO . 95.2 t -115.44 128.83 72.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -172.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 91' ' ' SER . 57.4 mt -94.34 101.94 13.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.631 176.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.6 m -80.99 145.94 8.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.102 0.477 . . . . 0.0 110.639 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 114.54 4.32 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.308 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 28' ' ' ALA . 89.3 mt -98.76 13.74 31.22 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 177.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.0 t -61.48 -22.21 64.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.196 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -106.36 4.21 28.31 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.002 0.429 . . . . 0.0 110.709 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.8 mt -116.54 117.19 54.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.022 0.439 . . . . 0.0 110.608 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -92.14 -32.79 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 111.056 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -80.7 43.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.593 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . 0.521 ' O ' ' HE3' ' A' ' 23' ' ' LYS . 69.0 p -87.1 10.84 15.4 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 122.12 -0.363 . . . . 0.0 110.699 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.38 -36.09 60.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.849 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.37 -13.5 52.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.0 110.0 176.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.2 tp -79.28 100.74 7.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.654 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -106.22 148.12 28.29 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.598 -174.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.462 ' HD2' ' O ' ' A' ' 21' ' ' VAL . 15.4 ptt180 -91.52 152.35 20.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.906 0.384 . . . . 0.0 110.238 177.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.87 25.67 8.37 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -169.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.01 -164.44 2.02 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.972 0.415 . . . . 0.0 111.132 -173.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -131.47 141.55 49.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.243 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.8 pt -134.2 148.95 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.991 0.424 . . . . 0.0 110.945 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 50.0 tttp -103.31 106.83 17.44 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 175.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.1 m -97.17 147.09 6.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.498 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 16.0 m-90 -112.48 109.79 19.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.759 173.266 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.454 ' HB3' HG22 ' A' ' 94' ' ' ILE . 14.2 p90 -120.8 179.27 4.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -142.54 -38.72 0.36 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.36 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.5 m -110.41 121.72 45.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.68 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -108.87 132.97 53.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.24 0.543 . . . . 0.0 110.21 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -99.7 124.11 44.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.233 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -79.95 50.54 1.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.066 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -71.91 -29.29 64.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.585 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.4 t30 60.77 99.09 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 O-C-N 123.812 0.695 . . . . 0.0 111.268 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.83 153.31 79.86 Favored 'Cis proline' 0 C--N 1.344 0.341 0 C-N-CA 123.579 -1.425 . . . . 0.0 112.764 1.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' VAL . 12.5 Cg_endo -56.16 138.81 84.3 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.918 2.412 . . . . 0.0 112.536 -177.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 20.8 t -118.35 137.88 52.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.435 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -128.38 102.83 6.83 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.867 0.365 . . . . 0.0 111.077 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.9 m -68.99 112.23 5.49 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.467 HG21 ' HB ' ' A' ' 79' ' ' VAL . 34.4 pt -106.19 147.88 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.018 0.437 . . . . 0.0 111.022 -175.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -111.1 -25.29 9.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.44 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -142.16 137.56 30.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.251 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -140.03 153.6 46.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.92 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.469 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 40.8 tt0 -114.9 128.76 56.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.815 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.89 105.85 10.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.384 -178.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.0 mt -85.07 78.57 9.86 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.62 125.78 25.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.334 -175.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -89.21 160.15 17.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.084 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -85.19 -32.9 22.43 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 171.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -81.61 106.11 13.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.711 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -126.93 147.29 50.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.974 176.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -85.95 5.78 31.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.201 0.524 . . . . 0.0 110.166 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -143.35 131.86 22.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.762 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 33.3 m80 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.062 176.205 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.6 mtp . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -83.73 115.16 22.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.029 0.442 . . . . 0.0 109.988 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.0 p -97.44 130.47 44.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.251 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -130.27 130.14 44.17 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.412 ' N ' HD13 ' A' ' 16' ' ' LEU . 50.8 t -95.54 123.51 47.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.22 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 176.61 27.29 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.706 -177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -101.24 134.84 43.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.66 0.267 . . . . 0.0 110.734 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 t -87.27 109.47 19.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.85 -36.76 4.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.103 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.737 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 89.6 mt -133.32 141.58 48.03 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -141.42 130.92 23.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.096 0.474 . . . . 0.0 111.624 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -115.83 -146.44 0.4 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 170.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -100.65 -55.73 2.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.029 0.377 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -90.46 -6.74 54.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.578 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -151.1 155.03 38.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.053 0.454 . . . . 0.0 111.437 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -141.72 149.5 40.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.085 176.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.737 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 70.4 mt -105.21 116.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.866 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 mt -118.78 151.91 37.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.282 0.563 . . . . 0.0 111.71 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -101.68 116.66 45.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.937 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.5 p -84.9 0.12 52.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.982 0.42 . . . . 0.0 111.301 -176.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -95.69 -172.22 2.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.496 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.4 p -106.16 -2.29 22.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -174.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -86.27 124.19 32.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.841 0.353 . . . . 0.0 110.367 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.34 145.65 34.45 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.812 176.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 16.7 Cg_exo -68.29 165.99 26.84 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.707 2.271 . . . . 0.0 112.44 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.4 176.61 37.09 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.19 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -51.62 -47.64 63.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 122.539 0.336 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.2 mt-10 -71.75 -26.24 62.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.532 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -67.1 -34.0 76.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.89 0.376 . . . . 0.0 110.201 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -74.27 -10.1 59.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.034 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -106.5 -5.11 19.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.877 0.37 . . . . 0.0 110.661 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 77.9 mt -74.54 163.78 27.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 48' ' ' GLN . 16.3 m -76.18 149.25 37.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 1.6 mp0 -49.48 -51.17 37.78 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.533 0.521 . . . . 0.0 111.321 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.82 -39.08 94.93 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.623 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' ' HB2' ' A' ' 45' ' ' SER . 83.2 mt-30 -64.75 -41.89 95.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.996 0.427 . . . . 0.0 110.291 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.98 -38.88 86.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.602 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.434 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 80.7 mtp -62.32 -40.86 97.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.189 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -72.66 -25.37 61.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 110.875 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -81.57 -54.46 5.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -92.71 23.88 3.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 0.0 110.528 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' ILE . 86.2 tttt -50.94 -28.8 10.53 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.518 -176.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -66.27 -31.59 72.5 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -143.57 28.86 1.43 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -173.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.463 HD11 ' CG2' ' A' ' 29' ' ' ILE . 15.1 tt -96.56 134.93 32.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.525 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.529 HG22 ' HG2' ' A' ' 90' ' ' PRO . 79.4 t -132.83 127.26 55.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.868 0.366 . . . . 0.0 110.354 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 63.9 mt -95.05 116.95 37.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 176.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 22.6 m -95.6 142.43 13.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.167 0.508 . . . . 0.0 111.68 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.15 114.39 4.2 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.431 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 28' ' ' ALA . 88.3 mt -96.59 9.87 40.22 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 122.61 0.364 . . . . 0.0 110.787 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.7 p -59.9 -31.15 69.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.074 0.464 . . . . 0.0 111.203 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.654 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 2.9 mm-40 -79.19 -19.46 50.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.293 -177.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.3 mt -103.55 113.37 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.584 -175.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -102.15 31.95 3.72 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.758 0.789 . . . . 0.0 110.618 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -145.3 37.72 1.13 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.3 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.474 HG21 ' HB3' ' A' ' 62' ' ' LEU . 40.7 p -69.86 5.01 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.04 -15.58 58.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.631 0.253 . . . . 0.0 111.287 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -89.3 -4.67 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.08 0.466 . . . . 0.0 109.944 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 tp -81.68 116.49 21.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.979 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -99.51 130.4 45.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.727 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.4 ptt85 -90.23 142.47 27.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.8 19.06 45.2 Favored Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 -171.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 6.1 mm-40 -134.67 -167.97 2.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.595 -171.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 88.3 tttt -127.76 138.77 52.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.924 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.523 HG22 HD12 ' A' ' 99' ' ' LEU . 38.3 pt -139.81 168.03 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 121.505 0.669 . . . . 0.0 112.233 -178.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -123.93 106.88 10.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.829 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.0 m -101.6 147.51 8.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -173.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.581 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 6.0 m-90 -110.22 115.4 29.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.815 173.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 44.2 p90 -127.94 172.34 10.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 0.0 111.008 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -155.95 -50.02 0.08 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.995 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 m -84.83 119.89 25.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.542 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 84' ' ' ARG . 13.9 ptt180 -139.13 153.03 47.92 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.938 0.399 . . . . 0.0 111.045 -176.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -120.64 106.43 11.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.71 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -86.96 97.94 10.98 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.14 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.8 m -112.27 -14.16 13.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.856 -175.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 60.73 93.59 0.06 OUTLIER Pre-proline 0 N--CA 1.467 0.411 0 O-C-N 123.479 0.487 . . . . 0.0 110.71 -172.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.45 ' HB3' HG23 ' A' ' 57' ' ' ILE . 14.7 Cg_exo -69.87 146.95 83.82 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.797 -1.335 . . . . 0.0 112.299 -1.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.529 ' HG2' HG22 ' A' ' 58' ' ' VAL . 62.0 Cg_endo -74.07 155.95 47.38 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.626 2.217 . . . . 0.0 112.783 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.6 p -128.02 145.05 51.11 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.712 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -129.95 128.54 42.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.681 0.277 . . . . 0.0 111.008 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.3 m -87.29 113.71 23.25 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 29.3 pt -108.29 129.44 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.059 0.457 . . . . 0.0 110.7 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.654 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 82.9 mt-30 -101.33 -9.43 21.18 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.664 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 51.6 tttm -158.72 140.98 14.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.3 165.76 26.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.872 0.367 . . . . 0.0 111.047 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -125.11 117.24 23.48 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.523 HD12 HG22 ' A' ' 77' ' ' ILE . 37.1 tp -70.64 137.99 50.37 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.375 -177.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 90.8 mt . . . . . 0 C--N 1.326 -0.442 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 175.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 61.9 mtm . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.603 0.239 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -85.42 120.08 26.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.14 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.409 ' HG ' ' HE1' ' A' ' 80' ' ' TRP . 7.9 m -96.44 128.45 43.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.502 -174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.441 HD12 ' CE1' ' A' ' 81' ' ' PHE . 11.6 mt -130.21 160.02 35.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.788 173.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -127.57 126.93 68.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.58 166.69 29.19 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.797 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -104.76 132.89 50.46 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.745 0.307 . . . . 0.0 110.285 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.534 HG21 HD11 ' A' ' 71' ' ' LEU . 12.0 t -89.15 100.65 11.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 m -92.12 -40.43 12.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.53 -177.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 99.0 mt -127.78 141.14 51.66 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.916 -178.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -126.39 136.25 52.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.759 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.718 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 7.7 t70 -135.92 -167.15 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -79.49 106.96 11.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 71.41 7.99 6.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.324 0.65 . . . . 0.0 111.841 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.718 ' HG3' ' HB3' ' A' ' 24' ' ' ASP . 32.9 ptt180 -146.46 140.21 26.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.798 0.332 . . . . 0.0 110.398 -176.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.5 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -128.65 142.57 50.99 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.435 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 60.4 mt -97.68 107.07 19.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.436 HD11 HG22 ' A' ' 20' ' ' VAL . 4.0 mm? -102.15 147.28 26.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.959 -176.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.435 ' HA ' ' O ' ' A' ' 56' ' ' ASN . 20.0 mt -106.31 123.71 61.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.076 173.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.5 p -81.71 -7.97 59.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.54 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.21 156.22 38.77 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 175.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.2 p -100.04 12.8 36.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -168.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -125.81 144.11 50.78 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 171.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.9 137.82 79.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 173.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.54 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 56.4 Cg_endo -69.99 177.38 5.79 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.474 2.116 . . . . 0.0 112.318 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.19 169.72 54.09 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.531 -0.843 . . . . 0.0 111.753 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -66.31 -27.01 67.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 37.4 mp0 -62.6 -42.49 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.376 176.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 14.2 m-20 -67.0 -35.27 79.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.433 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -69.6 -23.48 63.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.91 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.29 -15.37 38.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.423 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.7 mt -71.48 173.11 8.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.459 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.8 m -103.04 177.42 4.84 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.49 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.62 -47.54 81.91 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.073 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -33.15 72.39 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.635 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.5 ' HB3' HD13 ' A' ' 44' ' ' LEU . 78.8 mm-40 -65.07 -51.84 59.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.771 0.32 . . . . 0.0 110.63 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.3 mt -67.6 -31.38 71.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.491 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.613 ' HG3' ' HG3' ' A' ' 89' ' ' PRO . 47.9 ttm -63.01 -33.61 75.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.229 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -87.31 -44.62 11.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.224 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -69.82 -54.47 13.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.358 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.445 ' O ' HG22 ' A' ' 57' ' ' ILE . 99.4 m-85 -99.03 46.09 0.99 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tttp -52.15 -35.4 48.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.768 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.405 HD22 ' HA ' ' A' ' 55' ' ' ASN . 12.1 m120 -111.67 14.45 21.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.823 0.344 . . . . 0.0 111.425 -177.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 31' ' ' ILE . 18.6 m120 -122.88 -4.52 8.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.811 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.445 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.2 tt -97.47 116.36 39.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.531 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.516 HG22 ' HB2' ' A' ' 90' ' ' PRO . 88.4 t -120.88 116.28 49.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.362 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.551 HG12 HG12 ' A' ' 29' ' ' ILE . 59.9 mt -85.32 104.72 13.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 92' ' ' ALA . 34.9 m -93.92 141.29 15.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.167 0.508 . . . . 0.0 111.421 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.37 130.62 9.82 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.589 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 68' ' ' THR . 41.2 mt -105.61 7.74 32.89 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 124.177 0.575 . . . . 0.0 110.189 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.6 m -59.74 -28.56 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -172.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -95.07 -14.03 24.63 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.559 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 55.9 mt -107.34 104.28 16.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.73 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -77.53 -23.12 50.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.118 -177.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -85.55 41.04 0.87 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.222 0.534 . . . . 0.0 111.089 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.537 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.8 p -96.07 15.19 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.896 177.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -41.9 93.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.13 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.81 1.73 37.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.17 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.534 HD11 HG21 ' A' ' 20' ' ' VAL . 42.7 tp -77.11 121.18 23.23 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 30.4 mttp -120.69 -172.46 2.38 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.457 -175.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 73' ' ' ARG . 52.2 mtt180 -98.05 134.56 40.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 173.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 88.26 26.39 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 72' ' ' LYS . 9.8 mm-40 -103.5 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.016 0.436 . . . . 0.0 110.51 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -132.14 127.77 36.65 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 176.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.473 HG22 ' HA ' ' A' ' 99' ' ' LEU . 37.4 pt -137.25 155.01 31.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.426 0.631 . . . . 0.0 112.037 -176.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.458 ' HB2' HD11 ' A' ' 100' ' ' LEU . 86.0 tttt -106.95 114.8 29.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.574 173.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 22.6 m -104.56 139.5 25.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 0.0 111.944 -173.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.409 ' HE1' ' HG ' ' A' ' 15' ' ' SER . 4.8 m-90 -109.4 122.82 48.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.118 170.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.441 ' CE1' HD12 ' A' ' 16' ' ' LEU . 2.0 p90 -149.06 177.13 9.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.073 0.463 . . . . 0.0 110.912 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -144.79 -42.01 0.24 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.3 m -82.5 104.76 13.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.163 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -98.76 117.35 33.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -99.2 115.39 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.543 . . . . 0.0 110.523 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.23 90.97 4.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.259 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -98.29 -31.11 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.873 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.83 90.46 0.08 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 124.015 0.822 . . . . 0.0 110.715 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.613 ' HG3' ' HG3' ' A' ' 50' ' ' MET . 36.7 Cg_endo -62.37 151.4 63.99 Favored 'Cis proline' 0 C--N 1.354 0.842 0 C-N-CA 124.762 -0.932 . . . . 0.0 114.16 7.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.516 ' HB2' HG22 ' A' ' 58' ' ' VAL . 51.6 Cg_exo -54.35 144.03 62.81 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.602 2.868 . . . . 0.0 113.911 -174.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.1 t -130.48 164.31 25.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.579 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.414 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.25 170.43 22.28 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.697 0.284 . . . . 0.0 110.484 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -126.66 117.32 22.51 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 27.0 pt -89.46 141.82 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.439 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -95.46 -35.07 11.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.908 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -158.75 149.19 19.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.398 175.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' OH ' ' HA ' ' A' ' 68' ' ' THR . 13.2 p90 -138.93 143.71 38.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.257 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -114.68 129.41 56.68 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.359 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.473 ' HA ' HG22 ' A' ' 77' ' ' ILE . 57.3 tp -76.17 122.47 24.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.621 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 78' ' ' LYS . 87.3 mt . . . . . 0 C--N 1.324 -0.539 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.549 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 65.8 mtm . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -85.43 116.74 23.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 110.17 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.4 m -84.9 125.63 32.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.227 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.461 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 3.0 tm? -116.67 120.2 37.88 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.5 t -98.51 123.71 51.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.143 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.36 169.59 34.37 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.854 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -105.55 140.9 37.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.246 0.218 . . . . 0.0 110.52 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.562 HG21 HD11 ' A' ' 71' ' ' LEU . 22.6 t -87.76 113.92 25.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.64 -41.33 4.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.192 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 95.7 mt -134.02 160.17 38.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.814 0.34 . . . . 0.0 110.416 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -148.43 162.3 39.87 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.826 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -156.68 -164.68 1.7 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -75.81 -47.74 24.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 111.336 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -82.37 -45.89 14.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.861 -176.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.684 ' HG2' ' HA2' ' A' ' 61' ' ' GLY . 33.1 mtm180 -138.71 163.3 32.5 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.569 -169.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -116.12 152.49 33.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.314 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 58.6 mt -109.32 113.99 45.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.075 0.464 . . . . 0.0 110.787 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.53 HD13 HD11 ' A' ' 77' ' ' ILE . 66.9 mt -113.78 144.16 43.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.934 -176.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.3 mt -102.9 120.66 53.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -85.26 -7.58 58.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.095 0.474 . . . . 0.0 111.1 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 10.2 t70 -89.79 158.93 17.28 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.645 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.7 p -97.6 2.6 50.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -81.82 110.37 17.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 173.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.49 131.84 70.56 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.206 -175.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.35 160.39 47.94 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.845 2.363 . . . . 0.0 112.032 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.54 179.58 35.99 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.144 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 7.9 tmtm? -57.94 -41.42 82.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.851 0.358 . . . . 0.0 110.542 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.03 -27.51 64.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.235 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.08 -33.93 76.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.93 0.395 . . . . 0.0 109.967 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.45 -14.23 61.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -89.29 -22.18 22.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.009 0.433 . . . . 0.0 109.956 175.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -69.73 153.07 43.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.665 178.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.9 p -82.93 165.66 19.54 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.151 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 50' ' ' MET . 36.2 mp0 -48.72 -50.98 31.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.709 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.13 -48.99 83.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.748 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -64.02 -32.26 73.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.636 0.255 . . . . 0.0 111.142 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.8 tp -67.34 -41.85 84.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.534 ' HG2' HD13 ' A' ' 57' ' ' ILE . 65.0 mtt -65.7 -32.01 73.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -66.43 -36.03 81.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.867 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -82.81 -54.49 5.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.135 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.32 41.34 1.06 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.343 0.592 . . . . 0.0 110.238 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 77.9 tttt -60.79 124.99 22.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.607 -177.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 4.5 m-20 72.99 4.86 5.08 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.917 0.761 . . . . 0.0 111.256 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.518 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 13.6 m120 -118.63 11.91 12.96 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.534 HD13 ' HG2' ' A' ' 50' ' ' MET . 13.2 tt -129.06 134.2 64.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.196 -176.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 82.1 t -124.38 132.72 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.459 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 91' ' ' SER . 29.8 mt -98.94 104.9 16.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.645 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.9 m -94.21 128.87 45.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.32 0.581 . . . . 0.0 111.297 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 27' ' ' ARG . . . -80.33 122.06 5.63 Favored Glycine 0 N--CA 1.443 -0.893 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.669 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.42 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.7 mt -88.43 31.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.131 0.491 . . . . 0.0 110.061 -178.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.4 m -63.69 -26.17 68.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.632 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 64' ' ' GLU . 3.6 tp10 -105.26 -3.08 23.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.401 0.619 . . . . 0.0 110.081 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.7 mm -122.62 91.05 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.997 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -98.21 18.09 17.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 122.08 0.943 . . . . 0.0 109.913 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -121.15 14.39 11.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.493 -173.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 32.52 0.26 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -171.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -89.49 -14.66 34.8 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.363 0.601 . . . . 0.0 109.717 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -81.8 -28.52 33.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.451 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.562 HD11 HG21 ' A' ' 20' ' ' VAL . 12.6 tp -57.36 123.29 14.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.806 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -104.73 170.74 7.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 111.165 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.8 mtt85 -87.22 143.3 27.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.24 -0.437 . . . . 0.0 109.979 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.58 42.0 18.74 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -124.28 -174.88 3.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.221 0.534 . . . . 0.0 112.017 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.7 tttm -135.2 125.2 25.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.712 -175.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.63 HD13 HG13 ' A' ' 79' ' ' VAL . 2.6 pp -135.6 171.47 17.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.488 0.661 . . . . 0.0 112.708 -174.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -135.15 111.73 9.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.697 174.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.63 HG13 HD13 ' A' ' 77' ' ' ILE . 27.8 m -107.29 156.02 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.816 0.341 . . . . 0.0 111.208 -176.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 9.8 m-90 -122.69 130.59 53.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.838 175.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 94' ' ' ILE . 44.5 p90 -148.33 -178.34 6.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.034 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -140.99 -45.06 0.39 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.02 175.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.3 m -82.94 117.76 23.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 49.9 ptt85 -139.61 155.04 47.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.758 0.313 . . . . 0.0 110.58 176.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -122.34 128.98 51.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.372 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.52 59.49 4.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.42 0.628 . . . . 0.0 110.139 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -79.12 -22.27 45.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.697 177.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.468 HD22 ' N ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER 68.69 102.06 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.811 179.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.481 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 16.3 Cg_exo -69.0 146.8 81.63 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.829 -1.321 . . . . 0.0 112.194 -0.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 29.9 Cg_exo -61.26 137.56 71.5 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.837 2.358 . . . . 0.0 112.624 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 14.6 m -115.93 145.97 42.47 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.146 176.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -147.41 128.95 15.02 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.588 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 46.7 m -83.41 112.77 20.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.569 ' HA ' ' HB3' ' A' ' 81' ' ' PHE . 40.9 pt -87.04 149.85 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.105 0.479 . . . . 0.0 111.287 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -103.65 -48.09 4.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.32 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -138.48 163.97 30.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.05 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.524 ' HB2' HG12 ' A' ' 79' ' ' VAL . 6.2 p90 -164.23 159.06 19.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.665 0.269 . . . . 0.0 110.725 177.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -121.01 132.75 55.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.711 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 77' ' ' ILE . 38.4 tp -82.1 108.98 16.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.963 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.8 mt . . . . . 0 C--N 1.326 -0.447 0 CA-C-O 121.406 0.622 . . . . 0.0 109.858 -179.093 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.43 ' SD ' ' HD2' ' A' ' 96' ' ' LYS . 83.2 mtp . . . . . 0 N--CA 1.452 -0.343 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -83.26 121.81 27.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.762 0.315 . . . . 0.0 110.4 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 m -82.74 125.36 31.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.074 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.487 ' O ' HG22 ' A' ' 79' ' ' VAL . 2.7 tm? -138.72 120.59 15.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -89.97 139.16 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -149.61 145.5 13.75 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.18 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.864 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 87.5 m-85 -91.61 121.14 33.01 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.443 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 40.0 t -75.82 93.57 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.48 -38.13 7.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.094 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.793 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 93.2 mt -121.91 124.75 44.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.155 0.503 . . . . 0.0 110.19 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -124.61 119.05 27.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.936 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -118.47 13.61 13.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.121 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 75.08 -55.08 0.65 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.922 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -85.24 -36.77 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 27' ' ' ARG . 43.1 mtp180 -113.39 148.36 35.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.759 176.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.569 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -138.69 130.81 28.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.02 0.438 . . . . 0.0 110.62 175.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 66.8 mt -104.34 115.78 46.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.443 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.4 mt -114.47 147.18 39.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.125 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.89 129.12 53.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 168.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.5 p -53.93 -58.61 6.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.77 0.319 . . . . 0.0 111.005 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.864 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 35.4 t70 -164.71 140.4 5.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.52 0.676 . . . . 0.0 111.952 174.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.3 m -146.97 17.11 1.23 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm 48.25 64.02 1.83 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.975 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.412 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 61.58 96.43 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.994 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 24.7 Cg_endo -62.73 167.73 11.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.774 2.316 . . . . 0.0 111.998 178.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -92.18 167.0 30.01 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.978 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -62.97 -28.97 70.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.224 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 39.4 tt0 -66.06 -33.58 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.547 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.86 -34.03 73.05 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -73.87 -19.24 60.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.868 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -78.69 -30.92 46.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.357 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.8 mt -63.3 142.91 58.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.351 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.2 m -76.0 168.91 19.17 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.404 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.53 -49.55 45.62 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.495 0.497 . . . . 0.0 111.537 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.6 -45.62 95.99 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.22 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.73 -41.49 92.18 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.969 0.414 . . . . 0.0 110.675 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.13 -43.52 98.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.165 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 45.9 ttm -67.21 -34.35 77.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.342 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -71.7 -24.65 61.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.709 0.29 . . . . 0.0 111.245 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.88 -54.84 3.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.951 0.405 . . . . 0.0 110.777 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -97.4 40.17 1.17 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.639 -177.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -54.84 -34.99 63.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.417 -173.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -92.37 -5.34 52.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.678 0.275 . . . . 0.0 111.422 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -121.48 3.17 10.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.6 tt -96.28 121.91 47.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.327 0.584 . . . . 0.0 110.834 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.8 t -124.48 121.98 62.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.075 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 91' ' ' SER . 60.3 mt -91.76 105.85 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 34.1 m -98.75 150.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.264 0.554 . . . . 0.0 111.296 -175.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.53 126.58 8.68 Favored Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.841 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.577 ' HB3' HG21 ' A' ' 68' ' ' THR . 85.4 mt -100.72 19.0 17.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.182 0.515 . . . . 0.0 109.853 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.1 m -61.27 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.583 -176.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.65 -51.47 11.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.281 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 49.1 mt -89.28 108.68 19.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.469 -176.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.22 12.13 19.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.824 0.345 . . . . 0.0 111.227 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -112.89 34.52 4.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.304 0.573 . . . . 0.0 109.572 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 62' ' ' LEU . 5.8 p -89.3 2.53 54.21 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -80.22 -11.32 59.75 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.944 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.37 -25.03 63.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.295 172.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.26 158.61 28.51 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.536 174.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -142.86 154.45 44.15 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.722 178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.51 118.07 14.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.155 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 106.2 22.69 7.73 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.136 -0.785 . . . . 0.0 111.136 -175.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -113.48 165.08 12.82 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -127.42 124.39 38.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.922 0.392 . . . . 0.0 110.554 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 99' ' ' LEU . 39.5 pt -130.24 153.14 38.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.782 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE3' ' CZ2' ' A' ' 80' ' ' TRP . 35.9 ttpt -111.8 110.66 21.14 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 16' ' ' LEU . 8.6 m -99.6 159.23 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 111.869 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 20.9 m-90 -127.77 128.41 45.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.467 173.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -134.83 175.17 9.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.155 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -95.81 -37.75 10.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.161 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.1 t -154.71 157.19 37.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.535 ' HA ' ' HB2' ' A' ' 92' ' ' ALA . 50.7 ttp180 -121.39 134.92 55.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -88.11 125.26 34.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.951 0.405 . . . . 0.0 110.376 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -80.83 74.52 7.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.209 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -86.68 -24.3 25.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.899 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 33.4 t30 61.09 92.17 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.685 -174.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.44 156.75 96.76 Favored 'Cis proline' 0 C--N 1.345 0.355 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.392 -0.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.11 139.88 92.56 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.863 2.375 . . . . 0.0 112.662 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 18.1 p -135.31 142.75 45.89 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HA ' ' A' ' 84' ' ' ARG . . . -158.28 139.06 12.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.706 0.289 . . . . 0.0 111.19 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -81.17 115.77 20.75 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.4 pt -86.31 135.83 24.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.123 0.487 . . . . 0.0 110.488 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -106.05 -22.89 12.77 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.979 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.43 ' HD2' ' SD ' ' A' ' 13' ' ' MET . 65.2 mttp -142.88 147.34 35.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.915 177.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.487 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -152.81 156.77 39.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.987 0.423 . . . . 0.0 110.677 171.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -114.84 112.0 22.09 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.565 ' HA ' HG22 ' A' ' 77' ' ' ILE . 6.1 tt -72.31 113.31 9.21 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.9 mt . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.201 -172.685 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.505 ' HE1' ' HB2' ' A' ' 95' ' ' GLN . 75.4 mtp . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 85.1 mm-40 -83.76 115.19 22.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.089 0.471 . . . . 0.0 109.865 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.6 t -96.93 129.9 44.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.222 -172.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.9 137.37 29.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.7 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 62.1 t -97.68 137.76 24.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 32' ' ' THR . . . -148.62 154.5 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.432 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.7 127.14 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.436 ' HA ' HD22 ' A' ' 30' ' ' LEU . 10.9 t -83.02 102.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 p -120.51 -49.41 3.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.608 ' HB3' ' HB ' ' A' ' 29' ' ' ILE . 25.8 tp -122.7 138.76 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.773 0.32 . . . . 0.0 110.855 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -131.06 162.87 28.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.869 0.366 . . . . 0.0 110.781 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -123.05 -69.87 0.8 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.351 171.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -166.09 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.936 176.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -93.8 -15.43 25.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.243 0.544 . . . . 0.0 110.268 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 27' ' ' ARG . 14.6 ptt180 -116.49 141.37 48.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.811 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.41 145.94 47.4 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.425 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' A' ' 22' ' ' LEU . 66.6 mt -107.33 108.17 24.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.963 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 20' ' ' VAL . 58.8 mt -116.06 149.8 38.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.981 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.467 HD12 ' HG3' ' A' ' 37' ' ' PRO . 54.6 mt -109.26 122.05 63.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.402 ' HA ' ' HA2' ' A' ' 18' ' ' GLY . 23.9 p -94.3 7.56 44.96 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 34' ' ' THR . 31.9 t70 -163.58 -162.73 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.581 ' HG1' ' HE1' ' A' ' 53' ' ' PHE . 6.5 m 82.15 23.07 0.23 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.686 0.795 . . . . 0.0 111.854 175.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.0 tttm 56.8 42.52 26.5 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.414 169.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.63 134.36 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.543 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.467 ' HG3' HD12 ' A' ' 31' ' ' ILE . 45.1 Cg_exo -56.25 136.58 76.07 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.826 2.351 . . . . 0.0 112.107 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.63 -163.34 30.3 Favored Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.713 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -52.64 -58.29 7.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.859 0.464 . . . . 0.0 111.89 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -68.34 -27.29 66.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.754 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -67.76 -30.55 70.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.83 0.348 . . . . 0.0 110.648 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -83.49 -1.77 54.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.845 0.355 . . . . 0.0 111.06 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -110.6 -10.97 14.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 93.1 mt -79.6 149.15 31.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.031 0.443 . . . . 0.0 111.248 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.7 m -88.77 -178.93 5.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.242 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -55.2 -60.84 2.83 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.03 -33.97 86.1 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.569 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -71.49 -37.26 71.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.362 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.97 -42.77 94.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.566 176.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 80.4 mtp -66.77 -23.64 66.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.922 177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -74.95 -42.24 58.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.856 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -77.17 -45.71 25.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 110.668 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.581 ' HE1' ' HG1' ' A' ' 34' ' ' THR . 89.2 m-85 -98.81 44.65 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -175.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -44.09 -39.2 4.07 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -121.29 9.81 10.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -176.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -120.22 -5.45 9.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.8 tt -99.37 132.06 45.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.928 0.394 . . . . 0.0 109.955 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 63.5 t -122.97 126.97 74.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.945 0.403 . . . . 0.0 110.617 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.6 mt -96.72 100.91 11.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.6 m -89.1 141.99 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.124 0.488 . . . . 0.0 111.374 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.77 115.33 4.63 Favored Glycine 0 N--CA 1.441 -0.996 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.18 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.4 mt -94.47 27.09 3.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 0.0 110.123 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.5 m -55.57 -35.84 66.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.89 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 14.8 mm-40 -81.87 -6.91 59.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 111.092 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -114.32 99.91 9.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -68.45 -41.06 80.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.414 -174.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -107.01 106.75 17.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.929 0.395 . . . . 0.0 110.737 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -98.3 18.58 16.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.425 0.631 . . . . 0.0 109.517 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.39 -29.83 70.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.304 -171.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -81.28 -17.81 48.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt -71.5 125.06 26.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.908 0.385 . . . . 0.0 110.568 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -106.68 -172.59 2.11 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.878 -176.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 73' ' ' ARG . 15.8 ttt180 -111.36 126.01 54.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 177.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 33.65 5.36 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.781 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.09 179.58 3.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 111.103 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 48.9 mttp -129.44 129.6 44.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.397 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 99' ' ' LEU . 30.1 pt -130.84 145.13 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.019 0.438 . . . . 0.0 111.275 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.564 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 8.1 ttpm? -106.34 107.27 18.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.2 m -98.24 154.25 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.019 0.438 . . . . 0.0 111.711 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.564 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 23.2 m-90 -121.34 115.45 22.97 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.132 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.538 ' HB3' HG22 ' A' ' 94' ' ' ILE . 5.5 p90 -118.01 166.83 12.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.556 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -126.97 -25.61 3.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.357 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.8 m -117.86 111.61 19.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.937 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.7 mtm180 -108.45 140.1 42.25 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.035 172.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -121.59 110.23 15.74 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -79.25 87.6 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.985 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.4 p -102.15 -26.78 13.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.207 177.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.5 m120 57.98 90.96 0.08 OUTLIER Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.348 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.425 ' HB3' HG23 ' A' ' 57' ' ' ILE . 46.3 Cg_endo -67.82 136.04 32.19 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.81 1.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.75 153.31 29.69 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.61 2.207 . . . . 0.0 113.039 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -116.01 153.64 31.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.336 176.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -148.08 132.82 17.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.743 0.306 . . . . 0.0 110.758 -179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.9 m -90.71 116.22 28.41 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.936 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.538 HG22 ' HB3' ' A' ' 81' ' ' PHE . 46.8 pt -101.66 148.59 7.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.946 0.403 . . . . 0.0 110.725 -178.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.505 ' HB2' ' HE1' ' A' ' 13' ' ' MET . 97.0 mt-30 -111.44 -28.2 8.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.36 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -136.94 152.83 50.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.725 -179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -154.56 144.95 22.1 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -114.55 118.26 33.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.047 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.57 ' HA ' HG22 ' A' ' 77' ' ' ILE . 3.0 tt -77.62 111.11 13.04 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 76.4 mt . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.426 -175.505 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.0 mtm . . . . . 0 CA--C 1.519 -0.229 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -83.78 125.45 31.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.981 0.42 . . . . 0.0 110.474 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.0 m -85.24 124.72 32.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.539 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.488 HD11 ' HA ' ' A' ' 32' ' ' THR . 2.9 tm? -121.98 112.85 18.79 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.1 t -93.36 115.23 31.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 -172.07 18.12 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.752 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.35 136.06 54.82 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.923 0.392 . . . . 0.0 110.918 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.438 HG21 HD21 ' A' ' 71' ' ' LEU . 13.0 t -85.59 93.82 3.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.497 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 m -82.64 -34.98 12.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.842 -178.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.7 mt -133.52 127.58 33.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.107 0.479 . . . . 0.0 110.613 178.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -111.92 126.27 54.93 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.271 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 37.0 t70 -128.21 166.4 18.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 81.1 m-20 -67.77 106.56 2.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.835 0.35 . . . . 0.0 110.141 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 47.7 mt-10 78.82 5.81 2.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.645 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.797 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 9.3 mpt_? -127.83 119.61 26.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.914 0.388 . . . . 0.0 110.955 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.536 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -110.27 107.98 17.93 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.695 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 62.8 mt -85.73 104.35 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.49 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.435 ' CD2' HG22 ' A' ' 20' ' ' VAL . 36.5 mt -111.54 151.74 28.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.529 -171.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.472 HG22 ' H ' ' A' ' 33' ' ' ASP . 58.6 mt -97.45 123.71 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 168.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.488 ' HA ' HD11 ' A' ' 16' ' ' LEU . 12.2 p -78.6 -10.59 59.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.018 0.437 . . . . 0.0 111.396 -177.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.494 ' OD1' ' HG3' ' A' ' 35' ' ' LYS . 6.1 t70 -89.64 162.05 15.81 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.9 p -100.96 9.59 42.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.494 ' HG3' ' OD1' ' A' ' 33' ' ' ASP . 68.0 mttm -77.25 131.7 38.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.238 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.5 122.79 73.39 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.504 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 165.89 30.94 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.797 2.332 . . . . 0.0 112.168 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.72 -172.59 27.96 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.776 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.77 -41.27 99.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.027 0.441 . . . . 0.0 110.488 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 34.4 tt0 -64.71 -37.12 86.52 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.39 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.457 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.0 m-20 -60.53 -45.03 95.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -70.88 -14.35 62.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.527 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -93.91 -15.44 24.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.752 0.31 . . . . 0.0 110.749 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.3 mt -72.53 154.19 40.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.2 176.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.1 p -84.98 170.14 13.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -176.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -50.24 -48.75 54.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.236 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.3 -43.18 99.45 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.616 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -70.92 -35.96 72.46 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.77 -0.253 . . . . 0.0 111.348 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 41' ' ' ASP . 67.3 mt -68.91 -36.92 78.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.89 0.376 . . . . 0.0 110.471 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.494 ' HA ' HG21 ' A' ' 57' ' ' ILE . 42.6 ttm -61.78 -34.58 76.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.504 176.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -82.71 -44.35 15.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.319 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.09 -34.32 74.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -114.41 43.1 1.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.121 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -50.63 119.53 3.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.107 -176.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 69.15 0.19 2.73 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.75 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -96.15 -20.42 18.62 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 170.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.494 HG21 ' HA ' ' A' ' 50' ' ' MET . 8.4 tt -90.24 123.32 42.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.358 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -125.51 125.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.251 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.656 HG12 HG12 ' A' ' 29' ' ' ILE . 58.0 mt -94.57 108.86 21.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 ' HB3' ' A' ' 92' ' ' ALA . 24.8 m -98.25 143.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.471 . . . . 0.0 110.88 -179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.44 134.0 12.7 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.102 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.546 HD22 HG21 ' A' ' 68' ' ' THR . 69.4 mt -105.42 16.33 25.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.827 0.346 . . . . 0.0 110.245 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.2 m -60.54 -33.07 72.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.303 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.41 -33.87 61.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.684 0.278 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.7 mt -108.33 97.73 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.304 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.51 6.78 22.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.28 0.562 . . . . 0.0 110.88 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -99.12 14.51 29.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.21 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.546 HG21 HD22 ' A' ' 62' ' ' LEU . 6.9 p -86.4 7.64 24.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.62 -12.46 59.5 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.281 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.77 -19.99 61.93 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.981 174.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.438 HD21 HG21 ' A' ' 20' ' ' VAL . 25.3 tp -67.54 147.35 52.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.61 178.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -119.47 172.4 7.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.185 0.516 . . . . 0.0 111.73 -178.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -84.9 126.25 33.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.489 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.11 26.31 19.3 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -175.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -95.64 160.04 14.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 111.142 -173.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HG2' HD12 ' A' ' 100' ' ' LEU . 46.4 tttp -117.92 111.31 18.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -177.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.49 HG22 HD12 ' A' ' 99' ' ' LEU . 44.5 pt -132.4 171.84 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.745 0.783 . . . . 0.0 112.943 -173.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -133.45 111.65 10.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.882 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.493 ' HB ' HG21 ' A' ' 94' ' ' ILE . 34.9 m -106.62 157.43 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -117.39 123.06 45.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.098 172.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -126.22 157.71 37.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.813 0.34 . . . . 0.0 110.554 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -87.4 -36.88 17.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.093 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.8 t -150.11 168.61 23.42 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.238 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -123.77 132.0 53.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -110.21 95.24 5.46 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -82.81 84.6 7.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.198 0.523 . . . . 0.0 110.996 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 m -84.78 -12.47 53.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.115 175.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.7 m120 60.31 89.99 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.546 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.482 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 58.3 Cg_endo -70.13 151.24 92.23 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.877 -1.301 . . . . 0.0 113.132 2.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 11.0 Cg_exo -71.14 153.11 62.58 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.096 2.53 . . . . 0.0 113.107 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 t -135.4 160.91 36.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.654 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.542 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.14 170.66 21.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 23.9 m -131.74 130.9 42.51 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.493 HG21 ' HB ' ' A' ' 79' ' ' VAL . 44.5 pt -109.09 145.05 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.966 0.412 . . . . 0.0 111.158 -176.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -109.13 -16.24 14.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -161.71 147.72 13.78 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -152.19 164.9 36.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -114.8 136.45 53.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.867 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.49 HD12 HG22 ' A' ' 77' ' ' ILE . 29.8 tp -92.26 118.88 31.32 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.544 HD12 ' HG2' ' A' ' 76' ' ' LYS . 93.7 mt . . . . . 0 C--N 1.323 -0.58 0 CA-C-O 121.196 0.522 . . . . 0.0 110.582 -176.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.408 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 67.4 mtm . . . . . 0 N--CA 1.45 -0.458 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.39 116.55 22.54 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.511 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 12.3 t -103.9 144.57 31.33 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.199 0.523 . . . . 0.0 111.694 -171.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.0 OUTLIER -135.52 136.99 41.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.493 ' N ' HD13 ' A' ' 16' ' ' LEU . 58.7 t -106.19 124.11 61.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.7 0.286 . . . . 0.0 110.393 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.25 167.72 29.0 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.11 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -104.94 128.01 53.02 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.502 HG21 HD11 ' A' ' 71' ' ' LEU . 21.9 t -75.69 99.2 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.454 HG12 ' CE2' ' A' ' 42' ' ' TYR . 34.6 m -98.27 -38.73 7.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.671 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 94.4 mt -131.46 131.5 43.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.667 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -116.07 119.77 36.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.548 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -88.42 -73.69 0.49 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.396 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 171.73 -64.13 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.66 -25.72 21.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.141 175.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.9 OUTLIER -116.55 151.89 35.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.694 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.546 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.35 127.84 41.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.65 173.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.731 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 68.0 mt -89.68 107.93 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.2 mt -111.24 137.72 48.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.486 -177.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.448 HD11 HD13 ' A' ' 49' ' ' LEU . 9.7 mt -105.27 148.76 9.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.484 HG21 HD11 ' A' ' 16' ' ' LEU . 19.1 p -128.76 155.18 45.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.268 -176.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 54.28 41.26 32.08 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.631 0.582 . . . . 0.0 111.122 176.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -108.77 -4.59 16.81 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.011 -175.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.37 36.06 23.26 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.956 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 64.34 107.45 0.03 OUTLIER Pre-proline 0 N--CA 1.464 0.253 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.87 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 26.4 Cg_endo -63.14 163.67 22.14 Favored 'Trans proline' 0 C--O 1.237 0.443 0 C-N-CA 122.802 2.334 . . . . 0.0 112.293 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.459 ' O ' ' HD1' ' A' ' 42' ' ' TYR . . . -89.82 172.22 38.54 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.887 -178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.18 -25.54 68.12 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.659 0.266 . . . . 0.0 111.128 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.88 -29.96 56.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.071 0.462 . . . . 0.0 110.175 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -69.95 -35.7 74.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.459 ' HD1' ' O ' ' A' ' 38' ' ' GLY . 69.3 m-85 -71.12 -16.21 62.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.458 174.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -83.41 -28.94 28.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.045 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -67.9 142.55 56.03 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.306 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 m -91.32 -174.14 3.84 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.474 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -52.55 -56.22 16.75 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.026 -173.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.91 92.74 Favored Glycine 0 N--CA 1.454 -0.144 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.388 -177.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.63 -39.33 80.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.578 0.228 . . . . 0.0 111.148 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD13 HD11 ' A' ' 31' ' ' ILE . 90.7 mt -78.26 -35.67 47.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.964 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 42.9 ttm -58.83 -42.73 89.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -93.24 2.76 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.463 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -100.56 -40.48 7.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.196 0.522 . . . . 0.0 109.76 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 56' ' ' ASN . 81.0 m-85 -118.58 55.58 0.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.59 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -51.5 -35.95 42.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.5 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -100.42 -8.77 22.88 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.593 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 53' ' ' PHE . 2.9 m-20 -114.02 2.03 14.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -171.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 12.6 tt -98.48 123.74 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.113 0.482 . . . . 0.0 110.861 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -125.02 126.02 70.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.967 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 91' ' ' SER . 61.6 mt -97.84 105.18 16.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.9 m -90.68 150.44 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.277 -176.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.66 119.59 6.53 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.883 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 28' ' ' ALA . 35.4 mt -92.33 7.99 40.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.09 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.0 t -65.46 -23.69 66.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.296 -170.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -97.72 5.52 49.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.088 0.47 . . . . 0.0 111.214 -175.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 52.3 mt -95.75 154.96 3.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.253 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -68.93 0.13 Allowed 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.363 0.414 . . . . 0.0 110.928 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -163.41 131.04 3.55 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.507 HG21 HD13 ' A' ' 62' ' ' LEU . 37.0 p -97.29 35.3 1.63 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.039 -174.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -68.28 -22.56 64.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.091 -177.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -92.95 5.93 49.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.112 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.502 HD11 HG21 ' A' ' 20' ' ' VAL . 24.1 tp -99.02 121.19 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.365 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -114.1 -172.57 2.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.954 0.407 . . . . 0.0 110.544 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -85.47 146.1 27.11 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.479 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 76.46 39.93 29.19 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.636 174.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -127.02 158.62 36.45 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.619 -177.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 38.5 mttp -102.62 136.45 42.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.4 pt -133.1 140.44 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.336 0.589 . . . . 0.0 111.25 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 88.0 tttt -100.29 106.82 18.5 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 173.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 15' ' ' SER . 29.2 m -100.16 154.11 4.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.582 -172.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.507 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 18.6 m-90 -120.61 117.65 28.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.414 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.615 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -133.88 167.15 21.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.825 -175.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -152.37 -37.7 0.11 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.739 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 7.1 m -80.23 108.02 13.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.451 176.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -102.52 153.51 20.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.148 0.499 . . . . 0.0 111.532 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 98.0 mttt -133.6 114.01 13.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.747 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.9 58.31 3.35 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.852 0.834 . . . . 0.0 109.697 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.6 t -76.37 -16.4 59.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.171 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 p30 42.92 100.08 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 112.382 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.15 150.07 75.3 Favored 'Cis proline' 0 C--N 1.345 0.381 0 C-N-CA 123.804 -1.332 . . . . 0.0 113.053 3.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.47 136.54 74.96 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.014 2.476 . . . . 0.0 112.524 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.645 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 19.7 m -115.72 149.03 39.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.567 177.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 81' ' ' PHE . . . -143.53 121.63 12.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.794 0.33 . . . . 0.0 111.258 -177.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 29.3 m -82.07 113.67 20.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.615 HG22 ' HB3' ' A' ' 81' ' ' PHE . 35.2 pt -96.18 142.58 13.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.033 0.444 . . . . 0.0 110.697 -177.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -90.59 -19.28 23.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.092 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -171.01 150.26 3.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.655 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.77 157.94 31.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.507 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 23.2 tt0 -115.54 112.34 22.06 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.5 tp -71.58 107.18 4.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.739 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.416 ' HB2' ' HB2' ' A' ' 76' ' ' LYS . 78.5 mt . . . . . 0 C--N 1.322 -0.602 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.477 179.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.574 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 95.8 mmm . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 83.9 mm-40 -83.38 118.62 23.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 111.195 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 m -81.15 111.9 18.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.544 HD11 HG22 ' A' ' 32' ' ' THR . 2.0 tm? -130.92 124.89 32.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.75 132.3 37.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.786 0.327 . . . . 0.0 110.327 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.59 162.78 28.93 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.755 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -105.84 126.03 51.7 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.576 0.227 . . . . 0.0 110.648 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.44 107.62 4.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.467 HG13 ' HG ' ' A' ' 22' ' ' LEU . 12.2 p -120.23 -32.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 123.271 0.357 . . . . 0.0 111.062 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.992 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.9 mt -127.73 145.07 51.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.818 0.342 . . . . 0.0 110.999 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -119.1 135.8 54.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.35 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 0.9 OUTLIER -92.77 -66.77 0.9 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.141 171.128 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 6.1 t30 160.9 -51.45 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.18 -24.76 14.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.406 -1.27 . . . . 0.0 108.69 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 24.3 mtm180 -117.92 158.95 23.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.607 -1.178 . . . . 0.0 110.464 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -124.61 139.87 53.47 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 175.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 32.5 mt -102.41 109.29 26.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 mt -113.16 144.39 42.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.047 -172.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.76 119.74 35.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.883 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 HD11 ' A' ' 16' ' ' LEU . 75.9 p -81.78 -23.66 36.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.959 0.409 . . . . 0.0 110.665 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.401 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 38.7 t70 -78.48 95.08 5.05 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 174.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 t -63.88 90.69 0.06 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.155 0.978 . . . . 0.0 112.127 -173.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -138.35 135.56 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.656 -1.157 . . . . 0.0 108.356 172.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.35 113.24 15.41 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.498 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.0 158.02 50.27 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.62 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.37 168.99 48.92 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.938 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -64.1 -28.12 69.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.948 0.404 . . . . 0.0 110.593 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -81.38 -26.56 35.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.911 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.67 -34.73 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -69.33 -16.19 63.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.665 175.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -94.53 -18.06 21.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.772 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.92 152.87 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.117 0.484 . . . . 0.0 110.953 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.3 p -77.51 166.62 22.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.322 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HA ' ' CD1' ' A' ' 22' ' ' LEU . 37.2 tt0 -52.77 -52.69 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.936 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.68 -42.13 99.71 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.686 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -68.04 -37.38 81.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.754 0.277 . . . . 0.0 111.654 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.525 HD12 HD21 ' A' ' 22' ' ' LEU . 72.8 mt -70.42 -34.17 72.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.796 0.331 . . . . 0.0 110.501 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.415 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 62.7 mtt -73.22 -15.7 61.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.094 176.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -91.04 -40.16 11.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.861 0.363 . . . . 0.0 110.35 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.31 -47.71 69.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.449 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.65 46.86 0.94 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.81 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 50' ' ' MET . 57.0 tttp -56.27 131.14 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -176.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 69.19 -5.52 1.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.276 -0.874 . . . . 0.0 112.206 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 29.0 m-80 -106.14 9.75 32.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.579 0.704 . . . . 0.0 109.495 176.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 29' ' ' ILE . 20.2 tt -120.48 128.62 76.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.603 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HG2' ' A' ' 90' ' ' PRO . 53.7 t -121.98 137.84 54.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.893 0.378 . . . . 0.0 110.969 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 91' ' ' SER . 56.5 mt -95.93 111.13 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.97 139.03 18.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.155 0.502 . . . . 0.0 111.231 -177.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -87.57 113.09 3.93 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.573 HD11 ' HB2' ' A' ' 28' ' ' ALA . 59.5 mt -87.55 43.13 1.09 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.026 0.441 . . . . 0.0 110.39 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.4 t -59.52 -45.51 91.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.654 -176.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 1.1 mp0 -87.86 11.09 16.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.05 0.453 . . . . 0.0 111.27 -176.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 62' ' ' LEU . 51.4 mm -106.45 134.38 48.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.44 -64.27 1.21 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.163 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -123.69 140.64 52.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.7 p -111.45 27.58 9.54 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.163 0.506 . . . . 0.0 111.551 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -73.01 -25.13 60.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.189 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -74.59 -27.22 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.692 0.282 . . . . 0.0 111.118 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.06 125.13 25.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -114.74 150.98 34.49 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 48.2 mtm105 -68.83 112.46 5.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 171.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.0 33.38 4.67 Favored Glycine 0 N--CA 1.443 -0.897 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 -174.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -118.53 151.38 37.96 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.498 ' HG2' HD12 ' A' ' 100' ' ' LEU . 81.1 tttt -111.8 122.99 49.3 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.827 0.346 . . . . 0.0 110.755 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.489 HG22 HD12 ' A' ' 99' ' ' LEU . 38.2 pt -132.14 149.6 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.296 0.57 . . . . 0.0 111.347 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -105.96 108.13 19.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 97' ' ' TYR . 28.2 m -98.66 153.02 4.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.255 0.55 . . . . 0.0 111.632 -173.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.574 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 8.5 m-90 -121.2 113.46 20.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.802 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 94' ' ' ILE . 30.4 p90 -107.24 146.93 30.84 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.619 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -99.22 -25.17 14.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.326 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -160.29 152.59 20.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 92' ' ' ALA . 32.9 mtm180 -110.25 169.75 8.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.344 0.592 . . . . 0.0 111.064 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 91' ' ' SER . 57.5 tttp -140.74 91.39 2.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.015 -0.993 . . . . 0.0 108.47 173.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 35.2 tt0 -83.96 109.81 17.92 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.363 -173.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -121.08 -0.27 10.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.417 174.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 59.37 102.08 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.47 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.212 -175.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.42 146.07 72.14 Favored 'Cis proline' 0 C--N 1.344 0.301 0 C-N-CA 123.563 -1.432 . . . . 0.0 112.24 0.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.532 ' HG2' HG22 ' A' ' 58' ' ' VAL . 20.6 Cg_endo -62.82 138.78 70.82 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.489 2.126 . . . . 0.0 112.202 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 28.2 t -104.0 156.09 18.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 84' ' ' ARG . . . -147.56 108.58 4.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.685 0.278 . . . . 0.0 110.911 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.4 m -73.02 110.08 7.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.859 0.361 . . . . 0.0 110.601 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 81' ' ' PHE . 45.4 pt -98.95 147.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.356 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.686 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 96.7 mt-30 -109.61 -8.98 14.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.581 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -165.98 148.74 7.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.172 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.512 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -137.35 167.37 21.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 172.475 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -129.32 131.06 46.84 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.489 HD12 HG22 ' A' ' 77' ' ' ILE . 17.4 tp -79.17 111.87 15.83 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -178.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.498 HD12 ' HG2' ' A' ' 76' ' ' LYS . 86.0 mt . . . . . 0 C--N 1.324 -0.539 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.983 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.434 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 72.8 mtp . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.768 0.318 . . . . 0.0 110.333 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.4 mt-30 -88.67 135.3 33.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.848 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 35.8 p -101.67 139.43 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.634 -174.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.3 tp -140.34 120.82 14.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.542 177.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.434 HG22 ' HB2' ' A' ' 78' ' ' LYS . 55.9 t -90.23 127.01 43.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.293 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.64 158.6 27.73 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.148 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.791 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 80.0 m-85 -99.37 129.77 45.6 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.8 t -83.07 108.4 15.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.227 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.2 m -103.34 -28.48 3.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 123.318 0.386 . . . . 0.0 111.033 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 29' ' ' ILE . 39.2 tp -136.21 122.82 20.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.869 0.366 . . . . 0.0 110.55 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -105.96 123.57 48.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.659 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -113.04 167.57 10.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.84 -31.96 68.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.63 0.252 . . . . 0.0 111.517 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -122.76 1.86 9.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.593 0.235 . . . . 0.0 111.324 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -142.83 167.78 21.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.82 0.343 . . . . 0.0 110.665 -174.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.496 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.72 119.66 9.35 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.8 173.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.923 HD12 HD23 ' A' ' 22' ' ' LEU . 33.3 mt -85.73 107.86 16.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-O 121.217 0.532 . . . . 0.0 110.014 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.458 HD22 HG22 ' A' ' 20' ' ' VAL . 20.2 mt -110.44 141.94 42.85 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.163 -176.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.4 mt -101.92 122.13 53.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -71.47 91.77 1.06 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.083 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.791 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 45.9 t0 65.22 93.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.848 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.44 10.66 40.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.233 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 56.13 35.66 26.06 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -172.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.43 102.98 0.03 OUTLIER Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.61 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.4 157.21 32.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.869 2.38 . . . . 0.0 112.391 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.11 166.85 39.11 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.641 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -57.67 -37.38 73.29 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.744 0.307 . . . . 0.0 111.06 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 19.2 mm-40 -73.84 -24.01 59.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.64 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.6 -33.87 71.53 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.52 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 80.5 m-85 -74.82 -17.92 60.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.363 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -90.12 -12.62 37.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.062 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 85.5 mt -67.42 166.14 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.129 0.49 . . . . 0.0 111.079 176.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.1 p -97.65 171.78 8.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.82 -55.8 23.35 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.303 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -57.9 -41.19 94.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.264 -0.493 . . . . 0.0 112.842 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -63.42 -44.38 94.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.738 0.304 . . . . 0.0 110.692 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.68 -42.74 98.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.405 ' HG2' HD13 ' A' ' 57' ' ' ILE . 88.9 mtp -60.22 -33.88 72.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.652 -179.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -92.22 -34.89 14.1 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -71.33 -47.78 54.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.9 0.381 . . . . 0.0 110.425 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -106.04 44.08 1.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.633 0.73 . . . . 0.0 109.86 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 81.3 tttt -54.62 140.6 34.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.246 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 92.7 m-20 76.37 -40.96 0.4 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.62 0.768 . . . . 0.0 112.329 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -80.83 -1.04 41.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 0.0 110.806 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.517 HG23 ' HB3' ' A' ' 89' ' ' PRO . 7.4 tt -90.8 118.77 36.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.308 0.575 . . . . 0.0 110.43 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -117.92 125.19 74.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.108 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.679 HG12 HG12 ' A' ' 29' ' ' ILE . 55.1 mt -99.49 100.35 10.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 35.5 m -83.66 154.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.412 ' CA ' ' HA ' ' A' ' 93' ' ' THR . . . -96.41 125.95 8.63 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.934 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.57 ' HB3' HG21 ' A' ' 68' ' ' THR . 86.6 mt -109.31 9.74 25.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 -178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -64.78 -21.99 66.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.451 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -91.88 0.66 57.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.709 0.29 . . . . 0.0 111.156 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.34 117.8 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.868 0.365 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.76 -55.88 6.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.047 0.451 . . . . 0.0 111.658 -176.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -85.35 66.85 9.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.208 0.528 . . . . 0.0 111.736 -173.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 62' ' ' LEU . 69.1 p -99.54 8.9 44.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.229 172.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.79 -18.92 65.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.731 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -77.51 -12.43 59.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.302 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 15.5 tp -87.92 126.25 34.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.792 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.407 ' HD2' ' OE2' ' A' ' 75' ' ' GLU . 35.8 mttt -112.76 -179.82 3.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.133 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -88.57 59.56 5.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.85 0.357 . . . . 0.0 110.417 174.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.52 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 176.54 42.61 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HG3' HD12 ' A' ' 71' ' ' LEU . 40.5 mm-40 -111.87 173.18 6.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.288 0.566 . . . . 0.0 111.441 -173.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -137.48 102.23 4.72 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.641 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.1 pt -125.44 154.9 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.764 0.793 . . . . 0.0 113.093 -170.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.495 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 43.3 tttt -115.77 106.44 13.86 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.301 -1.318 . . . . 0.0 108.551 175.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 15' ' ' SER . 22.1 m -96.14 156.86 3.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -169.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.495 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 5.4 m-90 -122.99 126.44 47.16 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.338 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -136.86 160.16 39.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.584 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -96.45 -23.08 16.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -157.57 158.51 35.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.124 -174.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -122.98 154.16 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.18 0.514 . . . . 0.0 110.805 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -103.68 102.51 12.37 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -77.85 62.24 2.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.911 -175.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.7 p -81.66 -30.15 32.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.031 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 66.3 101.72 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.42 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.669 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.517 ' HB3' HG23 ' A' ' 57' ' ' ILE . 31.3 Cg_endo -63.11 142.13 42.3 Favored 'Cis proline' 0 C--N 1.347 0.484 0 C-N-CA 123.779 -1.342 . . . . 0.0 112.657 2.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 34.3 Cg_exo -58.91 134.91 63.26 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.79 2.327 . . . . 0.0 112.159 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.3 p -123.45 144.59 49.41 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.85 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -151.26 110.3 3.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.285 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.412 ' HA ' ' CA ' ' A' ' 61' ' ' GLY . 12.8 m -68.29 117.25 9.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.216 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG21 ' HB ' ' A' ' 79' ' ' VAL . 42.5 pt -100.6 151.77 5.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.154 0.502 . . . . 0.0 110.938 -176.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -112.78 -18.65 12.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.338 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -143.1 151.13 40.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.777 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 94' ' ' ILE . 1.2 p90 -155.93 150.01 25.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.965 0.412 . . . . 0.0 110.02 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.44 124.47 52.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.413 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.63 117.67 23.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.952 0.406 . . . . 0.0 110.393 -177.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt . . . . . 0 C--N 1.321 -0.655 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.084 179.813 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 70.3 mtm . . . . . 0 N--CA 1.449 -0.497 0 CA-C-O 120.848 0.356 . . . . 0.0 110.264 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -83.66 121.11 26.82 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.263 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.517 ' HB3' ' HE2' ' A' ' 78' ' ' LYS . 48.8 m -85.42 129.24 34.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.123 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 16' ' ' LEU . 1.1 tm? -137.5 124.56 21.54 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.8 t -90.31 126.67 43.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.99 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.44 169.31 29.05 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.359 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.415 ' CD2' ' HG2' ' A' ' 76' ' ' LYS . 94.2 m-85 -107.14 133.96 50.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.657 0.265 . . . . 0.0 110.353 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.412 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 20.0 t -85.39 110.27 19.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.34 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.8 t -107.23 -63.19 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 123.497 0.498 . . . . 0.0 110.704 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 1.018 HD23 HD12 ' A' ' 29' ' ' ILE . 41.6 tp -111.51 110.47 20.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.948 0.404 . . . . 0.0 110.702 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HE3' ' HA ' ' A' ' 69' ' ' ASP . 42.6 tttm -100.01 126.58 46.22 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 15.7 t70 -106.27 -158.08 0.64 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 174.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.452 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 72.9 m-20 -89.1 -54.72 3.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.172 0.511 . . . . 0.0 109.747 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -98.26 -10.72 23.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.027 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.2 mtt180 -131.87 149.7 52.37 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.733 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -127.13 115.36 19.0 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 172.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 1.018 HD12 HD23 ' A' ' 22' ' ' LEU . 34.7 mt -87.94 107.55 17.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.394 0.616 . . . . 0.0 110.396 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.3 mt -114.32 158.13 21.86 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.416 -176.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.55 ' CG2' ' HB ' ' A' ' 34' ' ' THR . 36.9 mt -110.37 123.8 66.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.3 p -78.14 107.85 11.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.375 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 54.05 75.49 0.27 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.634 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.55 ' HB ' ' CG2' ' A' ' 31' ' ' ILE . 10.0 t -108.56 -0.01 20.56 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.637 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.8 mttp 57.11 41.18 27.67 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.837 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.98 112.57 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.8 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.536 ' HG3' HG21 ' A' ' 34' ' ' THR . 6.5 Cg_exo -73.03 178.88 5.95 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.833 2.356 . . . . 0.0 111.469 176.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.5 166.23 25.27 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.31 -178.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -62.79 -27.21 69.15 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.6 mt-10 -59.71 -47.6 85.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.363 174.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -67.04 -32.87 74.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.833 -175.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.503 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 53.6 m-85 -73.45 -16.44 61.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 111.058 177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -93.44 -22.14 19.08 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.07 0.462 . . . . 0.0 110.143 178.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 89.7 mt -69.52 157.1 37.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.056 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -88.1 179.07 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.363 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -58.9 -43.58 91.06 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.346 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.8 -42.27 93.13 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.478 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mt-30 -64.16 -39.53 94.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.065 0.46 . . . . 0.0 110.429 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.2 tp -68.96 -48.38 63.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.34 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.439 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 41.3 ttm -55.88 -49.02 74.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.918 -174.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -81.98 -8.43 59.67 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -90.11 -51.5 5.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.003 0.43 . . . . 0.0 110.408 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -101.75 33.24 3.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -56.89 -29.52 63.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -170.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -101.44 3.43 40.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.452 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -132.84 18.16 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.124 0.487 . . . . 0.0 110.063 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.449 HD11 ' CG2' ' A' ' 29' ' ' ILE . 17.5 tt -109.75 134.08 52.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.744 -174.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.4 t -132.64 122.59 47.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.042 0.448 . . . . 0.0 110.448 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.715 HG12 HG12 ' A' ' 29' ' ' ILE . 48.4 mt -92.99 103.62 14.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.46 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.477 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.0 m -83.1 145.64 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.136 0.493 . . . . 0.0 110.714 -178.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.75 122.41 6.65 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.103 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.529 ' HB3' HG21 ' A' ' 68' ' ' THR . 68.5 mt -98.98 11.62 38.41 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.925 0.426 . . . . 0.0 110.188 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 m -57.42 -25.16 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.675 -174.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -98.37 6.47 47.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.158 0.504 . . . . 0.0 111.015 -176.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.0 mt -125.25 107.02 17.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -84.63 21.19 1.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.817 0.341 . . . . 0.0 111.792 -174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -157.77 81.58 0.87 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.16 0.505 . . . . 0.0 109.769 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 62' ' ' LEU . 10.2 p -114.21 9.08 17.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.908 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 41.7 m-20 -79.49 2.67 21.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.115 0.483 . . . . 0.0 111.292 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -82.29 -13.7 56.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.576 170.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.8 tp -76.2 130.63 38.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.468 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.568 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 4.2 mtpm? -106.02 165.12 11.44 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.393 -177.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -89.96 123.8 34.19 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 175.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.503 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 98.01 37.5 4.38 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.754 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.568 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 67.4 mm-40 -116.61 175.75 5.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 111.74 -174.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HG2' ' CD2' ' A' ' 19' ' ' TYR . 52.9 mtpt -124.44 123.57 40.44 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.182 177.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.5 pt -135.41 153.76 34.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.622 0.725 . . . . 0.0 112.294 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 98' ' ' GLU . 56.0 tttm -110.39 106.52 15.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.588 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 26.7 m -94.56 154.29 3.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.148 0.499 . . . . 0.0 112.179 -172.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.7 m0 -118.47 104.13 10.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.455 175.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.547 ' HB3' HG22 ' A' ' 94' ' ' ILE . 53.1 p90 -117.67 145.48 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.08 0.467 . . . . 0.0 110.637 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -99.29 -39.19 8.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.4 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 38.4 m -120.34 124.32 45.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.274 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -117.85 118.69 32.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.822 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -117.84 115.86 25.82 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.084 0.468 . . . . 0.0 109.76 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.517 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 36.2 mt-10 -87.95 85.61 7.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.286 0.565 . . . . 0.0 110.544 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 m -91.23 -6.62 53.08 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.633 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 50.1 t30 66.68 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.538 -176.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 61.4 Cg_endo -75.01 156.35 99.91 Favored 'Cis proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.375 -1.51 . . . . 0.0 112.641 -0.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.3 Cg_exo -61.28 141.2 92.2 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.914 2.409 . . . . 0.0 112.686 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.9 t -132.29 141.51 49.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.863 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.442 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -138.32 130.78 29.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.668 0.27 . . . . 0.0 110.775 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.6 m -83.68 119.76 25.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.547 HG22 ' HB3' ' A' ' 81' ' ' PHE . 44.9 pt -102.66 150.4 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.85 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.66 -48.96 4.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.101 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -140.67 169.7 17.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.457 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -155.72 158.11 37.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 0.0 110.895 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 78' ' ' LYS . 43.1 mt-10 -114.57 121.76 44.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.269 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 tp -72.9 121.48 20.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 121.049 0.452 . . . . 0.0 110.49 -177.168 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 75.2 mtp . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -90.74 130.24 36.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.791 0.329 . . . . 0.0 111.177 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -79.34 129.12 34.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.905 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.5 tt -128.46 116.88 20.39 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.2 t -98.79 122.59 50.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 155.97 26.65 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.38 -178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.44 ' O ' ' HA ' ' A' ' 30' ' ' LEU . 83.7 m-85 -83.99 127.87 34.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.675 0.274 . . . . 0.0 111.012 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.405 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 16.1 t -81.25 96.49 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.0 m -97.02 -36.92 6.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.858 0.361 . . . . 0.0 111.257 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.667 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 81.1 mt -140.25 147.15 39.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -135.94 140.9 44.36 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.4 -177.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 34.8 t70 -121.0 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 46.9 t30 -82.32 -33.88 28.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.461 . . . . 0.0 110.169 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -95.3 -33.16 12.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.848 -177.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -139.31 164.92 28.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.918 0.39 . . . . 0.0 111.35 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.534 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.72 133.79 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.978 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 57' ' ' ILE . 71.0 mt -90.65 107.04 18.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.026 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 40.6 mt -112.83 136.81 52.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.619 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.586 HG22 ' H ' ' A' ' 33' ' ' ASP . 41.4 mt -95.33 120.04 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 174.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.431 HG22 HD21 ' A' ' 16' ' ' LEU . 20.6 p -90.25 22.89 3.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.969 -175.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.586 ' H ' HG22 ' A' ' 31' ' ' ILE . 7.4 t70 -97.31 -167.07 1.48 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.266 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -99.26 -23.44 15.19 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.222 0.534 . . . . 0.0 110.707 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -87.1 140.02 29.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.923 -177.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -98.84 130.98 26.46 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 168.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.475 ' HB3' ' CB ' ' A' ' 41' ' ' ASP . 57.3 Cg_exo -53.76 150.11 30.47 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.959 2.439 . . . . 0.0 112.876 -177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.72 -171.54 35.94 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.635 -0.793 . . . . 0.0 111.996 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.06 -42.88 77.3 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 122.614 0.366 . . . . 0.0 110.843 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.633 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.8 mt-10 -65.4 -41.22 93.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.944 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.475 ' CB ' ' HB3' ' A' ' 37' ' ' PRO . 16.0 m-20 -65.07 -44.74 87.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.414 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -68.96 -19.08 64.16 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.863 0.363 . . . . 0.0 111.201 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.84 -23.68 23.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.547 -178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.0 mt -69.03 158.69 34.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.136 178.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -70.78 149.08 47.23 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -59.99 -31.64 70.11 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -172.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.01 -37.83 93.53 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.118 177.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 96.8 mt-30 -66.72 -49.04 67.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 177.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.83 -40.91 96.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.413 178.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 45.7 ttm -61.54 -33.77 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.785 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -81.19 -28.69 34.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.857 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 58.2 mtpt -64.18 -39.14 93.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.094 0.473 . . . . 0.0 110.291 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -113.46 43.39 1.77 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.64 178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -48.3 -37.71 17.07 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.401 HD22 ' HA ' ' A' ' 55' ' ' ASN . 11.5 m120 -116.72 13.53 15.16 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.346 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -121.91 25.13 9.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.352 0.596 . . . . 0.0 109.491 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.77 HD11 HG23 ' A' ' 29' ' ' ILE . 10.2 tt -130.14 139.12 52.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.688 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.7 t -127.76 123.81 61.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' A' ' 91' ' ' SER . 58.6 mt -94.83 103.06 14.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.1 m -84.1 144.77 9.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.048 0.451 . . . . 0.0 111.329 -175.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.19 122.57 6.36 Favored Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.649 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.552 HD22 HG21 ' A' ' 68' ' ' THR . 63.4 mt -95.25 -4.03 46.47 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.778 0.34 . . . . 0.0 110.536 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 m -59.26 -24.68 63.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.489 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -76.69 -38.58 54.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.49 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.442 HG22 ' H ' ' A' ' 67' ' ' ASN . 45.9 mt -106.68 100.14 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.996 0.427 . . . . 0.0 110.887 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -80.23 8.36 7.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.148 0.499 . . . . 0.0 110.7 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.442 ' H ' HG22 ' A' ' 65' ' ' ILE . 17.6 m120 -104.02 12.51 34.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.838 -177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.552 HG21 HD22 ' A' ' 62' ' ' LEU . 5.3 p -81.84 26.03 0.52 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -70.2 -36.63 74.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.868 0.366 . . . . 0.0 111.301 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.63 6.05 29.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.252 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.536 HD11 HD13 ' A' ' 77' ' ' ILE . 14.3 tp -71.54 115.83 11.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.944 0.402 . . . . 0.0 110.079 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 43.3 tttm -100.9 140.86 34.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.512 -174.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 74.1 mtt180 -72.78 152.53 41.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.283 173.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.29 41.39 38.24 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.696 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -143.24 -166.05 2.22 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HB2' ' A' ' 100' ' ' LEU . 63.1 pttt -144.28 145.45 32.03 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 99' ' ' LEU . 25.5 pt -135.47 152.08 31.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.268 0.556 . . . . 0.0 111.313 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -104.8 106.71 17.32 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.844 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 30.7 m -103.92 155.58 5.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.881 0.372 . . . . 0.0 111.434 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 6.6 m-90 -113.43 111.59 22.21 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.432 172.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 2.4 p90 -115.43 163.66 15.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.36 -175.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.34 -60.84 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -93.45 133.4 36.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.152 0.501 . . . . 0.0 111.547 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -115.91 117.11 29.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.365 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.713 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 67.2 mttm -85.97 135.28 33.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.962 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -92.6 42.52 1.1 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.995 -173.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.9 t -68.65 -31.84 71.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.843 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 48.6 t30 64.39 102.38 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.428 0 O-C-N 123.611 0.569 . . . . 0.0 110.705 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 27.2 Cg_exo -63.18 152.12 69.66 Favored 'Cis proline' 0 C--N 1.347 0.452 0 C-N-CA 124.076 -1.218 . . . . 0.0 113.022 2.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 45.6 Cg_exo -55.95 130.1 38.52 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.015 2.477 . . . . 0.0 112.275 -178.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.713 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 13.3 m -105.44 116.06 31.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.082 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -104.09 116.05 31.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.731 0.3 . . . . 0.0 111.215 -176.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.1 m -76.88 114.6 15.84 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.9 pt -96.65 139.04 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.915 0.388 . . . . 0.0 111.192 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -104.81 -25.87 12.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.786 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -147.72 163.64 36.06 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.639 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 2.6 p90 -162.01 150.35 15.0 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.989 0.423 . . . . 0.0 111.572 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -114.75 123.09 48.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.763 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.542 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -75.32 110.97 10.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.088 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.529 ' HB2' ' HG3' ' A' ' 76' ' ' LYS . 86.3 mt . . . . . 0 C--N 1.326 -0.44 0 CA-C-O 121.105 0.479 . . . . 0.0 110.679 -177.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.494 ' HB2' ' HB3' ' A' ' 80' ' ' TRP . 61.5 mtm . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 120.945 0.402 . . . . 0.0 111.594 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -83.2 126.81 33.04 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.675 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.2 m -91.61 132.12 36.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.891 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.438 HD12 HG22 ' A' ' 32' ' ' THR . 0.2 OUTLIER -137.26 130.3 30.68 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.399 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.22 126.41 52.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.68 169.15 29.23 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.218 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.476 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 87.7 m-85 -103.25 135.51 44.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.849 0.357 . . . . 0.0 110.769 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.77 96.18 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.046 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.5 t -96.11 -53.32 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.608 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.85 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 92.8 mt -116.5 136.19 53.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.977 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -126.88 130.18 49.67 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.209 0.528 . . . . 0.0 111.01 -178.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.38 175.53 5.47 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -74.49 -34.33 63.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -119.23 -0.32 11.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.579 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -143.18 165.29 27.84 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 -175.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.429 ' HB3' ' CG2' ' A' ' 60' ' ' VAL . . . -138.89 122.31 17.21 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.859 0.362 . . . . 0.0 110.074 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.85 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 53.6 mt -90.9 99.33 9.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.243 0.544 . . . . 0.0 109.637 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.7 mt -108.94 139.08 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.711 -173.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.3 mt -87.67 114.21 26.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.438 HG22 HD12 ' A' ' 16' ' ' LEU . 6.0 p -80.08 -16.19 55.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.05 119.42 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' HE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -80.56 69.85 7.15 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -171.186 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -128.99 120.31 25.82 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 168.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -67.15 114.12 16.87 Favored Pre-proline 0 C--N 1.327 -0.377 0 O-C-N 123.109 0.256 . . . . 0.0 110.799 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 11.4 Cg_exo -70.92 156.99 59.34 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 123.016 2.477 . . . . 0.0 112.158 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.22 -178.09 34.46 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.769 178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -58.25 -38.51 77.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.905 0.383 . . . . 0.0 110.746 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.6 mp0 -60.93 -40.44 93.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.474 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -72.92 -34.73 66.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.542 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -72.9 -20.08 61.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.613 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -82.1 -26.14 33.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.032 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.0 mt -61.96 145.17 53.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.5 m -88.32 -179.83 6.2 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.999 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.553 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 23.7 mp0 -54.24 -61.48 2.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.57 -172.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.23 -34.2 83.43 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.536 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.38 -41.26 89.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.838 0.352 . . . . 0.0 110.287 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.2 -33.36 65.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.657 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.564 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 66.1 mtt -64.4 -24.42 67.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.415 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -90.35 -31.5 16.87 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.5 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -78.37 -38.9 40.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.184 0.516 . . . . 0.0 110.261 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -113.59 55.39 0.72 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 50' ' ' MET . 20.8 tttt -61.38 112.67 2.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.469 -171.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 65.45 11.68 7.56 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.786 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -107.9 9.08 28.82 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.771 0.796 . . . . 0.0 109.199 174.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.562 HD11 HG22 ' A' ' 29' ' ' ILE . 18.8 tt -123.99 132.52 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.117 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.522 HG22 ' HB2' ' A' ' 90' ' ' PRO . 98.7 t -120.07 125.85 74.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.994 0.426 . . . . 0.0 110.981 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 HG12 ' A' ' 29' ' ' ILE . 56.4 mt -91.85 96.43 6.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.429 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.0 m -76.01 147.54 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.211 0.529 . . . . 0.0 110.704 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.87 119.87 6.14 Favored Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.769 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.531 HD13 HG21 ' A' ' 68' ' ' THR . 64.6 mt -89.1 27.08 1.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -38.25 80.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.371 -176.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.708 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 26.0 mm-40 -92.72 -9.38 40.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.687 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.422 HG22 HG23 ' A' ' 68' ' ' THR . 50.2 mt -117.36 104.64 16.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.044 0.449 . . . . 0.0 111.008 -175.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -82.23 -38.59 24.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.731 -178.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -81.01 47.99 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.446 0.641 . . . . 0.0 111.252 -175.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.531 HG21 HD13 ' A' ' 62' ' ' LEU . 2.2 p -85.36 18.39 2.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.573 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -73.99 -24.74 59.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.576 174.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.14 -26.33 65.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.928 174.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -83.42 121.48 27.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -119.29 165.53 14.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.903 0.382 . . . . 0.0 110.821 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -83.76 127.42 33.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.81 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.74 42.48 2.47 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.068 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -134.06 -171.15 2.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.177 0.513 . . . . 0.0 111.455 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 19' ' ' TYR . 83.6 tttt -138.69 129.52 26.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.107 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 pt -136.74 166.65 25.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.663 0.744 . . . . 0.0 112.586 -175.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HB2' HD11 ' A' ' 100' ' ' LEU . 55.8 tttt -122.56 106.98 11.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.309 177.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.527 ' HB ' HG21 ' A' ' 94' ' ' ILE . 30.1 m -98.41 149.34 5.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 120.988 0.423 . . . . 0.0 112.139 -171.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 13' ' ' MET . 5.6 m-90 -114.53 106.23 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.393 172.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.459 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.8 p90 -108.97 135.31 50.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.32 0.581 . . . . 0.0 111.106 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -91.61 -48.9 6.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.454 ' CG2' ' HB ' ' A' ' 93' ' ' THR . 8.6 t -104.68 126.64 51.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.281 0.562 . . . . 0.0 110.243 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -112.39 138.46 49.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.164 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.673 ' HB2' ' HB3' ' A' ' 91' ' ' SER . 58.9 mttm -118.04 134.28 55.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.0 0.428 . . . . 0.0 110.379 -178.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -110.02 56.5 0.62 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.485 0.659 . . . . 0.0 109.544 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 p -73.23 -23.36 60.35 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.53 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 63.87 99.78 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.629 0 C-N-CA 123.252 0.621 . . . . 0.0 111.293 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 34.0 Cg_endo -63.73 147.22 63.4 Favored 'Cis proline' 0 C--N 1.349 0.564 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.585 1.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 58' ' ' VAL . 34.8 Cg_exo -57.14 152.67 43.45 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.03 2.486 . . . . 0.0 113.082 -176.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB3' ' HB2' ' A' ' 85' ' ' LYS . 26.3 t -134.81 161.06 36.26 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.357 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.26 110.08 2.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.618 0.246 . . . . 0.0 110.599 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.454 ' HB ' ' CG2' ' A' ' 83' ' ' THR . 38.5 m -73.89 113.64 11.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.912 0.387 . . . . 0.0 110.09 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.527 HG21 ' HB ' ' A' ' 79' ' ' VAL . 31.8 pt -100.03 138.4 24.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.008 -177.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.708 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 39.7 mt-30 -104.85 -10.87 17.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.246 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -159.74 144.16 14.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.491 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.415 ' CD1' HD13 ' A' ' 65' ' ' ILE . 5.1 p90 -147.59 152.73 38.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.015 0.435 . . . . 0.0 111.12 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -114.56 144.17 43.81 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.092 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 51.2 tp -93.25 136.62 33.35 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 -178.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.6 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 120.772 0.32 . . . . 0.0 110.182 178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.46 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 67.5 mtm . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.68 0.276 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -83.85 125.89 32.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.717 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.5 t -109.55 141.16 42.44 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.378 -173.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 78' ' ' LYS . 67.9 mt -139.41 146.82 40.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.276 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.7 t -97.08 127.96 48.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 171.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 157.47 27.31 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.819 -176.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.403 ' HE1' ' HE3' ' A' ' 76' ' ' LYS . 65.3 m-85 -94.66 125.51 39.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.465 -0.368 . . . . 0.0 110.308 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.51 104.73 11.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.47 HG11 HD21 ' A' ' 49' ' ' LEU . 7.1 p -100.66 -42.04 9.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.861 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 66.8 mt -129.34 154.81 46.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.644 0.259 . . . . 0.0 110.42 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -148.44 142.11 25.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.09 0.471 . . . . 0.0 111.171 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.425 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 13.8 t70 -123.14 -155.72 0.67 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 171.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.425 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 6.9 t30 -102.76 -31.3 10.39 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -91.66 -35.61 14.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.92 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -135.88 165.64 25.16 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.171 -174.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.37 149.69 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.751 174.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.747 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 42.0 mt -106.41 111.55 35.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.957 0.408 . . . . 0.0 110.488 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.76 141.94 44.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.462 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.3 mt -106.71 118.79 55.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.3 p -79.65 120.66 24.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.231 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 60.82 -162.43 0.27 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.665 0.603 . . . . 0.0 110.379 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m 76.94 14.26 2.06 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.314 174.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 62.96 -174.62 0.15 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.356 -178.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -84.09 135.42 42.12 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.292 178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 32.2 Cg_exo -58.9 158.47 24.76 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.903 2.402 . . . . 0.0 112.452 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.5 174.08 55.15 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.266 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -62.07 -39.84 93.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.9 mp0 -65.05 -34.14 77.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.326 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -64.64 -36.6 84.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.698 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -75.57 -5.02 43.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.02 0.438 . . . . 0.0 111.042 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.408 HD22 ' HA ' ' A' ' 43' ' ' ASN . 10.3 m120 -109.16 -8.24 15.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.65 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.1 mt -76.34 148.48 37.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 175.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -75.69 165.05 25.63 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.669 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -55.09 -47.45 74.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.537 -173.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.02 93.73 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.608 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.86 -44.82 96.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 0.0 110.624 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 21' ' ' VAL . 25.1 tp -62.78 -43.94 97.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.724 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.41 ' HG2' ' CD1' ' A' ' 57' ' ' ILE . 87.3 mtp -64.68 -22.98 67.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.428 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -93.49 -9.56 37.98 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.54 -50.7 5.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.998 0.427 . . . . 0.0 110.339 179.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -102.55 40.07 1.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -57.83 -29.78 65.21 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.897 -169.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -93.94 -23.76 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -109.41 11.42 25.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.745 0.307 . . . . 0.0 111.615 -175.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CD1' ' HG2' ' A' ' 50' ' ' MET . 10.7 tt -91.65 125.04 44.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.3 0.571 . . . . 0.0 110.722 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.0 t -118.84 120.43 64.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.942 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 66.1 mt -92.43 101.88 13.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -86.22 140.1 16.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.226 0.536 . . . . 0.0 111.236 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -92.17 125.89 8.28 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.292 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HG21 ' A' ' 68' ' ' THR . 63.2 mt -94.44 14.43 20.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.091 0.472 . . . . 0.0 110.531 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -60.08 -28.46 67.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.845 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 17.3 mm-40 -89.39 -3.44 58.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.442 -176.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' ASN . 26.5 mt -119.58 117.67 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.105 0.479 . . . . 0.0 110.249 -177.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -86.12 7.83 23.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.403 0.621 . . . . 0.0 111.136 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' ILE . 23.5 t-20 -153.94 83.77 1.15 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.168 -176.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.525 HG21 HD22 ' A' ' 62' ' ' LEU . 1.2 p -119.77 13.16 12.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.445 0.64 . . . . 0.0 110.614 177.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -72.98 -9.12 58.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.764 -175.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -92.68 5.86 49.51 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.081 -0.387 . . . . 0.0 111.049 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.7 tp -90.57 140.85 29.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.221 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.494 ' HD3' ' CD ' ' A' ' 75' ' ' GLU . 6.6 mptt -124.58 -178.52 4.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -93.17 123.23 36.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.052 174.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.61 42.69 2.11 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.556 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.494 ' CD ' ' HD3' ' A' ' 72' ' ' LYS . 53.9 mt-10 -128.3 177.84 6.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.896 0.379 . . . . 0.0 110.947 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.403 ' HE3' ' HE1' ' A' ' 19' ' ' TYR . 59.9 mttp -121.05 135.19 55.25 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.463 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.2 pt -137.62 152.99 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.334 0.588 . . . . 0.0 111.483 177.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 82.8 tttt -110.2 107.28 17.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.605 176.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.717 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.3 m -95.17 154.65 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -170.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.46 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 12.7 m-90 -125.78 123.38 38.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.636 172.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.554 ' HB3' HG22 ' A' ' 94' ' ' ILE . 55.5 p90 -140.07 171.35 14.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.003 0.43 . . . . 0.0 111.089 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 62.8 t60 -147.27 -35.8 0.23 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.494 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 2.5 m -76.47 98.78 4.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.063 175.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.0 ttt180 -94.73 120.95 35.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.406 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -119.8 139.35 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -121.57 101.62 7.72 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.464 -0.495 . . . . 0.0 110.864 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.5 t -104.8 -11.66 16.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.311 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 49.4 t-20 65.65 99.51 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 O-C-N 124.078 0.861 . . . . 0.0 109.675 -174.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 68.6 Cg_endo -72.28 171.4 63.33 Favored 'Cis proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.004 -1.248 . . . . 0.0 113.227 3.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.73 140.61 84.7 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.02 2.48 . . . . 0.0 112.798 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.8 p -130.04 115.75 17.56 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.417 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.4 125.05 50.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.764 0.316 . . . . 0.0 110.884 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 24.3 m -84.62 107.56 16.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.554 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.0 pt -96.44 139.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.113 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -103.14 -5.32 23.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.539 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -173.26 151.34 2.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.734 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -143.84 163.4 33.49 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.61 120.99 42.06 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.463 ' HA ' HG22 ' A' ' 77' ' ' ILE . 37.0 tp -75.24 109.71 8.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.961 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 43.5 mt . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 121.066 0.46 . . . . 0.0 110.533 -176.564 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.532 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 53.1 mtp . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.885 0.374 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 13.4 mp0 -83.79 161.63 20.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.055 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 m -102.85 128.66 49.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 0.0 111.45 -175.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.617 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 4.7 tt -116.7 109.5 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.8 t -93.9 117.78 38.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 158.69 27.77 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.473 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -96.25 127.82 42.61 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.0 t -75.92 97.3 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -103.4 -37.5 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -176.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 29' ' ' ILE . 36.8 tp -136.26 126.69 26.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' HB2' ' A' ' 71' ' ' LEU . 62.4 tttm -146.46 125.54 12.88 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.664 -177.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -70.41 0.57 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.106 0.479 . . . . 0.0 110.245 176.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -154.68 -60.59 0.12 Allowed 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -97.61 -20.2 17.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.928 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 27' ' ' ARG . 19.8 mtm180 -104.13 123.88 48.08 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.967 0.413 . . . . 0.0 110.954 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.521 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -111.05 112.92 25.08 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.956 176.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.736 HD12 HD23 ' A' ' 22' ' ' LEU . 54.1 mt -86.03 109.46 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.473 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.22 143.01 42.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.688 -175.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.9 mt -104.97 123.0 58.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -76.78 101.23 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.548 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.3 t70 64.28 101.77 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.812 0.695 . . . . 0.0 111.364 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.15 -7.24 4.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.36 40.2 29.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -174.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.25 102.84 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.289 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.503 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -50.72 -63.52 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.186 2.591 . . . . 0.0 112.849 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.7 148.69 5.44 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.757 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -61.21 -37.71 83.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.477 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.8 -26.64 44.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.5 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 2.3 m-20 -65.41 -32.2 73.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.762 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -69.66 -14.19 62.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.918 0.389 . . . . 0.0 110.63 176.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -99.6 -18.07 17.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' HA ' ' A' ' 41' ' ' ASP . 87.6 mt -63.26 149.91 44.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.029 0.442 . . . . 0.0 110.989 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -76.25 171.26 14.83 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.871 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 50' ' ' MET . 41.9 tt0 -56.27 -54.62 43.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.346 -176.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.03 -37.5 91.67 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.469 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -65.28 -43.37 91.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.984 0.421 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.5 mt -68.23 -40.02 82.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.948 177.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 85.5 mtp -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.998 -177.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.59 -34.12 14.15 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.974 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -76.66 -43.9 36.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.057 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -110.09 39.82 2.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.871 0.844 . . . . 0.0 109.107 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.419 ' O ' HG22 ' A' ' 57' ' ' ILE . 26.7 ttpt -53.93 -48.64 70.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.723 -170.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -86.51 0.52 54.1 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -175.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -124.98 17.99 8.5 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.709 -176.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 89' ' ' PRO . 13.6 tt -103.36 124.14 57.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.193 0.521 . . . . 0.0 111.74 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.534 HG22 ' HG2' ' A' ' 90' ' ' PRO . 70.1 t -124.33 137.54 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.301 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.657 HD12 HG12 ' A' ' 29' ' ' ILE . 13.3 mm -104.2 100.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.142 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.418 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.3 m -89.01 139.95 16.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.257 0.551 . . . . 0.0 111.046 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -94.36 117.2 5.47 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.948 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 68' ' ' THR . 49.0 mt -95.75 11.03 34.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.626 0.37 . . . . 0.0 110.562 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.1 m -63.93 -14.83 56.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.441 ' OE2' ' HG2' ' A' ' 95' ' ' GLN . 27.5 tt0 -96.72 -3.33 42.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.21 0.529 . . . . 0.0 110.418 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.463 ' CG2' HG23 ' A' ' 68' ' ' THR . 31.1 mt -113.23 109.92 30.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.91 11.36 9.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.814 -168.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -136.9 24.01 3.07 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 122.207 -0.308 . . . . 0.0 111.763 -177.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.556 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.7 p -80.43 37.73 0.41 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.78 -21.22 25.24 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.046 0.451 . . . . 0.0 110.623 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -73.95 -17.73 60.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.976 -174.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.521 ' HB2' ' HE3' ' A' ' 23' ' ' LYS . 3.2 mm? -71.31 122.79 20.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.745 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -108.01 171.19 7.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.424 -179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -86.4 117.9 25.5 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.43 33.56 2.68 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.759 -177.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.63 -177.48 4.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -135.13 135.0 40.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 -175.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 99' ' ' LEU . 32.1 pt -137.93 151.45 25.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.432 0.634 . . . . 0.0 111.7 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.438 ' HB2' HD11 ' A' ' 100' ' ' LEU . 47.9 tttm -115.33 106.75 14.38 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.541 172.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.447 ' CG2' ' HB3' ' A' ' 16' ' ' LEU . 30.1 m -100.77 154.15 4.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.323 -174.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.532 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.2 m-90 -104.81 119.46 39.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.642 174.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.617 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -136.79 171.99 13.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -164.57 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.465 -0.789 . . . . 0.0 108.892 175.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 0.2 OUTLIER -75.3 90.68 2.63 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.991 174.506 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 84' ' ' ARG . 23.0 ttt180 -108.45 117.84 35.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.131 0.491 . . . . 0.0 110.787 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -112.47 94.51 4.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.399 -0.819 . . . . 0.0 108.839 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.767 ' HG3' ' HB3' ' A' ' 90' ' ' PRO . 27.3 tt0 -85.47 109.71 18.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.362 0.601 . . . . 0.0 111.283 -173.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p -108.68 -11.63 15.05 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.583 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.0 t30 62.01 96.18 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.354 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.433 -173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.448 ' HB3' HG23 ' A' ' 57' ' ' ILE . 39.4 Cg_endo -66.63 144.1 66.91 Favored 'Cis proline' 0 C--N 1.344 0.317 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.677 1.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.767 ' HB3' ' HG3' ' A' ' 86' ' ' GLU . 41.4 Cg_endo -68.7 139.87 45.3 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.715 2.277 . . . . 0.0 112.656 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 29.8 t -111.28 153.45 25.9 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.21 131.18 19.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.682 0.277 . . . . 0.0 111.074 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 11.9 m -85.91 126.89 34.43 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.559 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.3 pt -117.47 153.04 19.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.519 -178.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HG2' ' OE2' ' A' ' 64' ' ' GLU . 80.0 mt-30 -110.6 -38.17 5.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.035 176.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -130.8 150.91 51.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.736 -172.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 1.7 p90 -152.07 154.1 35.27 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 0.0 110.712 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.411 ' OE2' ' HD3' ' A' ' 78' ' ' LYS . 42.0 mt-10 -117.21 114.34 23.51 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.502 175.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 77' ' ' ILE . 65.1 tp -71.38 104.41 3.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.438 HD11 ' HB2' ' A' ' 78' ' ' LYS . 73.1 mt . . . . . 0 N--CA 1.446 -0.663 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 69.3 mtp . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -83.84 119.56 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.321 -177.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.9 t -83.59 109.89 17.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 -178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD11 HG22 ' A' ' 32' ' ' THR . 3.2 tm? -116.52 119.31 35.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.693 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.444 HG22 ' HG3' ' A' ' 78' ' ' LYS . 30.5 t -94.08 129.65 44.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 162.8 28.93 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.656 -176.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.414 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 94.8 m-85 -100.89 126.46 47.51 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.71 91.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.705 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.494 HG23 ' CE1' ' A' ' 42' ' ' TYR . 2.9 p -93.15 -39.48 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.674 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.745 HD23 HD12 ' A' ' 29' ' ' ILE . 39.8 tp -130.27 133.01 46.18 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -131.37 137.47 48.74 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.827 0.346 . . . . 0.0 110.338 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.16 -176.98 3.24 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.22 -37.68 52.84 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -94.54 -37.31 11.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.782 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -137.56 174.75 10.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.983 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.419 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.89 149.24 33.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.511 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.745 HD12 HD23 ' A' ' 22' ' ' LEU . 42.3 mt -106.25 115.92 48.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.078 178.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.0 mt -110.09 138.48 46.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.404 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.8 mt -95.21 118.51 41.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.533 HG22 HD11 ' A' ' 16' ' ' LEU . 14.5 p -79.93 89.7 5.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.226 -174.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.414 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 38.5 t70 55.5 86.91 0.05 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.442 171.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -148.44 31.63 0.81 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.521 0.677 . . . . 0.0 110.064 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 63.91 28.05 14.5 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.269 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.44 150.9 0.11 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.67 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.483 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 95.3 Cg_endo -81.26 161.41 20.17 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.205 1.937 . . . . 0.0 111.559 173.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.86 173.29 30.52 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.145 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -58.78 -28.43 65.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.278 0.561 . . . . 0.0 109.714 177.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.59 -38.85 75.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.89 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 54.6 m-20 -81.17 -28.34 35.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.37 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . 0.494 ' CE1' HG23 ' A' ' 21' ' ' VAL . 91.7 m-85 -74.02 -18.88 60.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.129 0.49 . . . . 0.0 109.841 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -80.43 -37.21 32.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.177 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 78.8 mt -64.1 162.0 15.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.27 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.9 m -81.54 162.97 22.97 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -32.96 72.52 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.292 -173.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.78 -41.55 93.58 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.14 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.43 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 93.7 mt-30 -66.73 -38.01 85.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 110.193 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.8 tp -68.66 -40.66 80.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.008 175.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.542 ' HG3' HD13 ' A' ' 57' ' ' ILE . 47.9 ttm -61.54 -29.42 69.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -81.74 -35.14 30.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.97 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -71.98 -52.26 17.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.919 0.39 . . . . 0.0 110.683 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -95.35 46.39 1.11 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.515 0.674 . . . . 0.0 109.321 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.1 tttp -53.37 -35.08 59.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.362 -1.29 . . . . 0.0 113.247 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -109.04 1.31 20.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -120.71 7.16 10.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.608 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.542 HD13 ' HG3' ' A' ' 50' ' ' MET . 10.9 tt -93.43 123.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.968 -179.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.25 129.36 73.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.281 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.446 HG12 HG12 ' A' ' 29' ' ' ILE . 59.7 mt -95.57 108.2 20.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.834 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.77 142.98 12.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.262 0.553 . . . . 0.0 111.326 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.31 115.99 4.51 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.816 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.506 HD22 HG21 ' A' ' 68' ' ' THR . 69.8 mt -105.18 -4.8 21.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.735 0.303 . . . . 0.0 110.665 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.5 m -62.98 -29.21 70.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.321 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -90.65 9.56 29.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.121 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.448 HD12 HG13 ' A' ' 94' ' ' ILE . 58.2 mt -137.72 95.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 174.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -75.16 -9.66 58.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -176.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -89.81 33.5 0.85 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.641 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.506 HG21 HD22 ' A' ' 62' ' ' LEU . 8.0 p -101.93 21.17 15.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.131 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -80.6 -31.26 36.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.522 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -74.16 -10.57 59.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.583 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.4 tp -71.87 119.82 16.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.919 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -99.39 144.46 28.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.507 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -77.63 133.01 38.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.75 48.29 3.7 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -175.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HG2' HD11 ' A' ' 99' ' ' LEU . 6.0 tp10 -140.98 171.44 14.07 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -116.19 139.19 50.6 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.1 pt -139.36 154.68 25.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.27 0.557 . . . . 0.0 111.587 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.444 ' HG3' HG22 ' A' ' 17' ' ' VAL . 38.4 ttpt -116.58 107.0 14.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.168 -0.923 . . . . 0.0 108.899 174.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 25.3 m -96.85 158.96 3.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.042 0.449 . . . . 0.0 111.59 -173.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 3.3 m-90 -126.39 122.02 34.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.225 173.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -133.28 158.1 43.78 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.183 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -112.72 -12.19 13.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.06 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.9 m -141.11 137.18 32.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.165 -176.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.2 mtm-85 -112.38 140.48 47.06 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 174.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.787 ' HB3' ' HB2' ' A' ' 91' ' ' SER . 82.6 tttt -84.44 117.68 23.8 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 104.43 1.72 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.362 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.8 p -162.09 176.36 10.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.356 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 12.8 m120 -134.17 110.57 11.79 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.698 175.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 11.5 Cg_exo -71.36 156.25 96.84 Favored 'Cis proline' 0 C--O 1.235 0.368 0 C-N-CA 123.772 -1.345 . . . . 0.0 112.609 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.7 138.79 87.7 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.703 2.268 . . . . 0.0 112.149 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.787 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 21.6 m -112.54 158.32 20.08 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.273 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -150.79 101.38 2.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.887 0.375 . . . . 0.0 111.289 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 27.4 m -71.19 115.54 10.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 65' ' ' ILE . 37.7 pt -89.8 154.24 3.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.261 0.553 . . . . 0.0 111.736 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -104.76 -23.0 13.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.203 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 97' ' ' TYR . 51.6 tttt -162.32 159.56 25.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.318 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 30.2 p90 -148.89 157.67 43.6 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 175.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -114.48 116.25 28.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.74 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -72.48 108.76 5.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.937 179.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.7 mt . . . . . 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.287 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.401 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 61.3 mtm . . . . . 0 CA--C 1.519 -0.228 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -87.14 116.77 25.43 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.634 ' HB3' ' CD1' ' A' ' 80' ' ' TRP . 17.8 p -94.15 133.85 37.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.728 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.402 HD12 HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -133.75 130.86 38.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.602 176.78 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -93.74 133.11 35.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.195 179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -155.66 167.64 33.14 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.301 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -97.0 134.08 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.635 0.255 . . . . 0.0 110.776 178.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.2 t -83.64 106.36 14.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 25.5 m -104.34 -34.8 3.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.882 0.372 . . . . 0.0 111.552 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.724 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 84.8 mt -135.82 140.38 44.19 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -136.42 119.26 16.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.431 0.634 . . . . 0.0 111.901 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 18.7 t70 -97.54 176.33 5.9 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 170.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -64.21 -38.77 92.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.653 0.264 . . . . 0.0 110.453 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -107.65 -41.31 5.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.692 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 51.1 mtm-85 -104.2 115.8 31.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.108 0.48 . . . . 0.0 112.215 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.455 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -100.96 121.97 42.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.873 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.724 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 67.6 mt -91.3 110.83 22.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.011 -178.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 mt -109.87 147.34 33.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.749 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.6 mt -104.8 113.34 41.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.149 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HD12 ' A' ' 16' ' ' LEU . 10.2 p -90.65 -19.18 23.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.621 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 34.2 t70 -65.99 119.49 11.44 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 172.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.5 m -75.85 85.96 2.82 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.788 0.804 . . . . 0.0 112.07 -170.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -140.23 136.58 33.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.592 -1.186 . . . . 0.0 108.635 172.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -72.13 118.2 65.1 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 5.2 Cg_exo -78.81 115.61 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.603 2.202 . . . . 0.0 111.431 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 -163.66 25.18 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.774 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.36 -44.17 79.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.547 0.213 . . . . 0.0 111.206 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -67.78 -32.75 73.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.821 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -65.47 -36.76 84.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.125 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -85.72 -6.13 59.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -88.03 -26.49 22.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 110.319 176.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.33 147.54 47.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.212 177.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 57.3 p -75.67 161.53 29.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.348 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -53.17 -41.86 65.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.559 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.11 -53.15 48.1 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.491 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.91 -37.22 86.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.101 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.6 tp -61.23 -44.34 97.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.327 0.584 . . . . 0.0 109.849 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 51.9 ttm -70.86 -20.41 62.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.074 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.31 -38.63 63.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.197 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -79.61 -48.9 13.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.888 0.375 . . . . 0.0 110.94 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -91.27 23.67 3.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.837 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.409 ' HG2' HD21 ' A' ' 88' ' ' ASN . 84.3 tttt -50.16 -42.26 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -171.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -98.45 12.1 36.1 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 16.0 t-20 -154.49 34.44 0.41 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.322 0.582 . . . . 0.0 111.19 -177.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.6 tt -119.8 132.43 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.5 t -121.47 125.35 73.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 0.0 111.391 -174.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.8 mt -101.35 114.87 41.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 27.1 m -98.89 145.16 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.187 0.518 . . . . 0.0 111.373 -176.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -95.14 114.22 4.8 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.045 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 68' ' ' THR . 42.4 mt -87.06 4.77 40.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.048 0.451 . . . . 0.0 109.914 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -56.84 -37.24 70.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.51 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -85.23 -7.21 59.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 0.0 110.997 -178.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.9 mt -94.53 -39.24 10.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.681 176.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 76.08 -37.98 0.32 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.351 172.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -130.27 87.83 2.56 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.385 0.612 . . . . 0.0 109.658 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.538 ' HB ' HD13 ' A' ' 62' ' ' LEU . 4.0 m -119.62 24.58 10.54 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 174.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -18.36 52.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.541 -1.663 . . . . 0.0 113.202 -172.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -66.67 -27.5 67.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.922 0.391 . . . . 0.0 110.606 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 77' ' ' ILE . 3.6 mp -73.81 145.29 45.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.342 0.591 . . . . 0.0 111.8 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -119.47 157.88 27.38 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.197 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 73' ' ' ARG . 7.9 ptt180 -76.94 71.7 3.46 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.105 0.955 . . . . 0.0 110.768 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 162.48 48.7 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -138.06 -173.88 3.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.187 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -126.98 124.75 40.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.757 -176.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.622 HG21 HD21 ' A' ' 71' ' ' LEU . 42.8 pt -136.34 166.85 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.644 0.735 . . . . 0.0 112.43 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -131.31 106.94 8.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.46 -1.245 . . . . 0.0 108.562 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.4 m -95.86 150.73 4.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.634 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 5.4 m-90 -116.11 118.31 32.5 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.736 173.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.539 ' HB3' HG22 ' A' ' 94' ' ' ILE . 19.0 p90 -124.77 176.62 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.105 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -93.71 -43.14 8.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.927 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -162.76 177.85 8.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.456 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -123.68 136.0 54.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.914 0.388 . . . . 0.0 111.0 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -99.13 97.65 8.74 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HG2' ' HG3' ' A' ' 90' ' ' PRO . 1.5 tm-20 -87.36 87.89 7.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.256 0.551 . . . . 0.0 110.141 -174.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.5 p -108.02 2.89 23.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.251 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.479 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 27.1 t-20 60.18 101.11 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.364 -177.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 73.9 Cg_endo -75.98 152.38 96.6 Favored 'Cis proline' 0 CA--C 1.53 0.325 0 C-N-CA 123.29 -1.546 . . . . 0.0 112.658 -0.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.509 ' HG3' ' HG2' ' A' ' 86' ' ' GLU . 31.9 Cg_exo -59.09 120.54 8.46 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.646 2.231 . . . . 0.0 112.003 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.6 m -105.69 142.69 34.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.635 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -142.37 121.79 13.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.85 0.357 . . . . 0.0 111.443 -177.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.6 m -81.49 110.05 16.53 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.539 HG22 ' HB3' ' A' ' 81' ' ' PHE . 37.8 pt -96.43 155.49 3.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.608 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.35 -29.43 5.5 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.464 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -135.03 155.17 51.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.885 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -153.7 148.1 26.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.178 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.458 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 34.3 tt0 -114.69 119.71 37.65 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 53.6 tp -78.6 119.5 21.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.504 -177.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 98.1 mt . . . . . 0 C--N 1.321 -0.638 0 CA-C-O 121.132 0.491 . . . . 0.0 110.367 -179.229 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.462 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 75.6 mtm . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -83.63 116.78 22.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -175.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.566 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 10.8 t -107.94 139.5 42.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.013 -169.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.431 HD12 ' C ' ' A' ' 15' ' ' SER . 6.0 mp -138.47 163.32 32.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.298 174.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -95.71 140.42 17.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 136.84 6.09 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.055 -1.069 . . . . 0.0 112.468 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -90.25 124.47 34.9 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.966 0.412 . . . . 0.0 110.115 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.9 t -82.01 104.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.983 -177.269 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 HD21 ' A' ' 49' ' ' LEU . 15.9 m -100.98 -41.28 8.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.177 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.705 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.1 mt -130.23 146.1 51.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 110.515 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -132.85 123.54 26.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.314 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 67.6 m-20 -101.33 -2.91 29.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 174.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 t30 75.63 -55.59 0.62 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.478 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.71 -18.91 50.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.599 0.714 . . . . 0.0 109.186 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 14.7 mtm180 -135.16 159.74 40.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.802 175.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.75 127.61 31.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.055 0.455 . . . . 0.0 110.518 175.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.705 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 56.9 mt -95.4 101.53 12.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.456 HD22 HG22 ' A' ' 20' ' ' VAL . 32.4 mt -115.05 140.91 48.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.124 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -90.67 111.47 23.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -83.2 -9.34 59.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.306 0.574 . . . . 0.0 110.979 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -90.38 157.58 17.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.324 176.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.9 p -89.53 3.44 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -172.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.42 93.92 4.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 109.898 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.97 128.1 92.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.435 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 96.3 Cg_endo -78.94 -178.93 5.01 Favored 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 123.008 2.472 . . . . 0.0 112.671 -178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.66 -176.37 20.62 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.521 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -68.38 -23.12 64.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.968 0.414 . . . . 0.0 110.637 -177.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 27.3 mp0 -70.81 -38.41 73.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.377 177.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 7.8 m-20 -65.17 -38.54 90.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.491 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -65.94 -19.03 65.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.889 0.376 . . . . 0.0 111.018 175.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.43 -20.48 23.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.939 178.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 99.2 mt -74.76 153.37 38.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 177.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.2 p -77.68 168.68 19.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.52 ' HG3' HD13 ' A' ' 22' ' ' LEU . 1.6 mp0 -53.77 -42.65 68.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.77 178.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.53 -49.33 70.24 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.222 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.432 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 77.9 mm-40 -64.11 -43.52 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.928 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.519 HD21 HG21 ' A' ' 21' ' ' VAL . 29.1 tp -64.31 -47.23 80.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.245 -177.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.458 ' SD ' HD11 ' A' ' 59' ' ' ILE . 68.3 mtm -75.82 -13.36 60.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.484 -177.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -89.07 -35.44 16.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.086 0.47 . . . . 0.0 110.295 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -73.38 -49.22 28.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.349 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.58 47.12 0.93 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -59.12 121.02 10.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.794 -172.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 69.35 4.83 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.041 -0.981 . . . . 0.0 112.358 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -104.83 5.59 33.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.585 0.707 . . . . 0.0 109.281 173.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.611 HD11 HG22 ' A' ' 29' ' ' ILE . 19.4 tt -126.04 140.14 49.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.697 -176.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -122.53 129.07 75.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.124 0.488 . . . . 0.0 111.086 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.458 HD11 ' SD ' ' A' ' 50' ' ' MET . 60.4 mt -94.91 107.76 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 175.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.484 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.5 m -88.91 145.2 7.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.255 0.55 . . . . 0.0 111.032 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.13 115.19 4.53 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.346 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 28' ' ' ALA . 87.2 mt -94.98 21.48 7.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.005 0.431 . . . . 0.0 110.307 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 27.2 p -60.6 -25.79 66.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.333 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -87.45 -9.31 54.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.011 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.439 HD11 ' HA ' ' A' ' 96' ' ' LYS . 47.7 mt -128.32 105.59 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.23 -177.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -81.66 -11.85 58.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.707 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -116.04 82.07 1.71 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.547 0.689 . . . . 0.0 109.813 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.588 HG21 HD13 ' A' ' 62' ' ' LEU . 38.4 p -111.14 17.68 20.11 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.219 -0.901 . . . . 0.0 108.606 174.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.88 -27.32 69.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.341 -1.3 . . . . 0.0 111.306 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.73 -23.48 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.065 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 23.9 tp -65.19 131.7 47.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -117.76 172.8 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.228 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 73' ' ' ARG . 23.8 mtm180 -98.0 137.56 36.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.809 0.338 . . . . 0.0 110.31 176.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.33 23.33 22.19 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -116.97 -173.12 2.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.075 0.464 . . . . 0.0 111.404 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HG2' HD12 ' A' ' 100' ' ' LEU . 78.3 tttt -141.82 123.21 14.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.972 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 pt -130.98 168.9 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.388 0.613 . . . . 0.0 112.004 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -116.48 117.84 31.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.08 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.566 ' O ' ' HA ' ' A' ' 15' ' ' SER . 26.8 m -104.29 148.69 8.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.511 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 6.8 m-90 -125.67 116.76 22.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.148 175.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.59 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.1 p90 -126.05 167.6 15.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 0.0 111.886 177.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.71 29.66 2.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.075 177.028 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -172.29 148.22 2.08 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.617 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -149.5 139.39 21.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -113.43 141.67 46.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.141 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.25 47.47 1.34 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.852 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.9 p -64.85 -37.82 88.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 55.57 93.95 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 O-C-N 123.875 0.735 . . . . 0.0 111.764 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 38.7 Cg_exo -60.98 135.38 14.62 Favored 'Cis proline' 0 C--N 1.354 0.824 0 C-N-CA 124.163 -1.182 . . . . 0.0 112.788 3.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 36.9 Cg_exo -59.43 141.45 97.53 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.125 2.55 . . . . 0.0 113.009 -175.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.0 p -116.22 151.09 36.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.89 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.34 119.15 9.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.741 0.305 . . . . 0.0 110.808 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 45.6 m -78.55 110.72 13.9 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.366 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.59 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.1 pt -96.13 143.76 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.659 -178.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -93.07 -28.81 16.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.615 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.439 ' HA ' HD11 ' A' ' 65' ' ' ILE . 67.8 mttm -150.89 159.58 44.46 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.339 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -147.65 147.6 30.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.595 176.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.511 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 28.0 tt0 -114.42 136.88 52.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.185 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.31 120.83 25.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.506 HD12 ' HG2' ' A' ' 76' ' ' LYS . 92.9 mt . . . . . 0 C--N 1.323 -0.563 0 CA-C-O 121.047 0.451 . . . . 0.0 110.209 -179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.1 mtp . . . . . 0 N--CA 1.45 -0.449 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.6 mt-30 -83.66 125.27 31.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.173 0.511 . . . . 0.0 110.442 -171.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.2 m -100.81 134.47 43.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.809 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.51 HD12 ' CE2' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -117.75 124.37 48.3 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 174.297 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.1 t -94.52 117.87 39.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.87 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.61 167.37 29.21 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.85 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.44 146.14 26.66 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.9 t -101.23 108.44 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.463 HG22 ' HG2' ' A' ' 37' ' ' PRO . 47.0 t -101.17 -59.66 3.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.856 0.36 . . . . 0.0 110.821 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.701 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 85.6 mt -116.65 159.51 22.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.405 -175.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -143.95 124.22 13.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.621 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 8.1 t70 -77.92 -66.4 0.85 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.124 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 49.3 t30 163.72 -60.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.662 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -90.62 -17.09 27.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.827 -1.078 . . . . 0.0 109.68 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -124.77 151.07 45.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.493 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.532 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -122.73 138.61 54.57 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.17 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.701 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 73.3 mt -99.05 104.08 15.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.913 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.8 mt -112.63 156.44 22.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.712 -172.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -106.39 109.0 26.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.229 171.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.0 p -83.84 72.55 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.8 0.809 . . . . 0.0 109.763 177.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -157.34 -167.36 2.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.606 -175.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -110.63 -11.98 14.38 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.952 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.68 132.43 46.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.057 0.456 . . . . 0.0 111.652 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -99.37 115.87 65.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.265 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HG2' HG22 ' A' ' 21' ' ' VAL . 18.1 Cg_exo -66.63 146.17 78.36 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.819 2.346 . . . . 0.0 112.169 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.77 -179.36 31.98 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.667 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.51 -40.07 81.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.849 0.357 . . . . 0.0 110.864 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.543 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.8 tt0 -64.3 -31.57 72.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -72.03 -35.03 69.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.833 0.349 . . . . 0.0 110.363 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.73 -25.07 61.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.063 0.459 . . . . 0.0 109.896 174.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -75.37 -27.91 59.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.139 176.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 95.7 mt -65.96 155.84 35.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.247 176.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.8 p -90.53 174.07 7.73 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.411 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.81 -50.96 55.16 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 123.41 0.444 . . . . 0.0 111.821 -176.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.62 -42.5 99.69 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.619 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -65.71 -39.1 90.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 0.0 110.254 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.31 -44.68 94.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.145 176.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.667 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 76.2 mtp -67.84 -18.35 64.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.967 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -91.56 -21.36 20.89 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.745 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -86.12 -51.32 6.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.328 0.585 . . . . 0.0 109.733 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -96.23 49.64 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' MET . 33.6 tttp -53.65 118.21 3.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.522 -170.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 64.89 10.34 6.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.584 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -106.31 15.26 26.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.753 0.787 . . . . 0.0 109.278 175.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.569 HD11 HG23 ' A' ' 29' ' ' ILE . 8.8 tt -107.97 135.53 46.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.335 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.536 HG22 ' HB2' ' A' ' 90' ' ' PRO . 74.6 t -126.76 131.66 70.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.854 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 72.2 mt -97.24 109.14 22.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 175.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.0 m -93.09 140.99 15.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.295 0.569 . . . . 0.0 111.318 -177.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.63 118.65 5.29 Favored Glycine 0 N--CA 1.442 -0.965 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.36 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.658 HD13 HG21 ' A' ' 68' ' ' THR . 11.0 mt -99.26 17.78 19.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.3 p -65.59 -14.23 60.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.685 -176.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -86.45 -12.45 49.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.004 0.43 . . . . 0.0 110.325 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.479 HG22 ' H ' ' A' ' 67' ' ' ASN . 30.5 mm -117.65 108.8 25.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.893 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -91.98 16.53 10.92 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.468 0.651 . . . . 0.0 110.004 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . 0.479 ' H ' HG22 ' A' ' 65' ' ' ILE . 95.2 m-20 -134.22 31.44 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.019 -176.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.658 HG21 HD13 ' A' ' 62' ' ' LEU . 1.7 m -86.45 44.13 1.12 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.378 0.609 . . . . 0.0 111.861 -171.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.57 -23.54 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.543 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -83.58 5.59 23.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.105 0.479 . . . . 0.0 111.074 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 97' ' ' TYR . 9.9 tt -97.52 115.82 28.55 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -100.18 -172.36 2.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.399 0.618 . . . . 0.0 111.354 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -96.82 141.52 29.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.19 168.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.45 31.27 28.04 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.818 176.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -119.08 -168.01 1.49 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.932 0.396 . . . . 0.0 110.419 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -138.38 134.59 34.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.7 pt -135.63 158.33 39.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 112.421 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -117.64 106.77 13.45 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.932 173.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 19.1 m -100.65 148.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.95 0.405 . . . . 0.0 111.866 -172.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.509 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 7.9 m-90 -106.23 104.92 14.72 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.331 173.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.513 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -107.21 159.08 16.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.057 -177.456 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -112.38 -30.97 6.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.771 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -134.57 127.17 30.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.973 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -119.25 123.61 44.69 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 174.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -125.1 121.03 33.09 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.621 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.79 83.6 7.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.939 0.4 . . . . 0.0 110.313 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -84.24 -13.77 51.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.833 175.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 66.2 t30 58.12 92.72 0.06 OUTLIER Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.151 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 15.0 Cg_exo -67.96 143.64 69.78 Favored 'Cis proline' 0 C--N 1.346 0.421 0 C-N-CA 123.836 -1.318 . . . . 0.0 112.768 2.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' A' ' 58' ' ' VAL . 31.7 Cg_exo -58.22 142.7 97.47 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.715 2.277 . . . . 0.0 112.327 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 15.5 m -122.82 156.63 34.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.637 179.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.533 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -146.47 136.36 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.558 0.218 . . . . 0.0 110.879 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.5 m -94.41 114.7 26.77 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.513 HG22 ' HB3' ' A' ' 81' ' ' PHE . 2.8 pp -104.11 142.0 18.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.782 -177.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -105.22 -9.56 17.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.753 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.27 147.6 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.461 ' CE2' HD12 ' A' ' 71' ' ' LEU . 4.7 p90 -134.07 146.67 50.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 0.0 110.703 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.509 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 33.2 tt0 -116.24 126.45 53.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.812 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 39.6 tp -75.97 135.92 40.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.31 0.576 . . . . 0.0 111.4 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 58.3 mt . . . . . 0 C--N 1.324 -0.539 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.502 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.511 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 76.7 mtm . . . . . 0 N--CA 1.451 -0.41 0 CA-C-O 120.678 0.275 . . . . 0.0 110.372 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -88.56 139.11 30.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.577 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.6 t -88.88 124.5 34.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.963 0.411 . . . . 0.0 110.887 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.36 125.49 42.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.869 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 60.7 t -105.33 120.9 56.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 174.47 28.26 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.432 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -102.07 136.62 41.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.472 HG22 HD22 ' A' ' 30' ' ' LEU . 11.4 t -91.6 102.7 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.725 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.41 HG23 ' HG ' ' A' ' 22' ' ' LEU . 17.2 m -100.21 -35.58 4.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.499 -178.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.898 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 70.1 mt -129.72 138.52 51.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -176.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -148.73 127.92 12.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.8 175.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.26 -80.68 0.53 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.773 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -144.4 -66.57 0.34 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -89.94 -18.76 25.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.135 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -119.97 140.21 51.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.492 0.663 . . . . 0.0 112.048 -172.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.577 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.62 117.74 27.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.156 172.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.898 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 47.5 mt -88.63 105.91 16.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.752 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.472 HD22 HG22 ' A' ' 20' ' ' VAL . 20.8 mt -106.42 157.61 17.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.966 -176.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.9 mt -103.48 120.55 53.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -31.81 68.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.195 0.521 . . . . 0.0 110.787 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.54 130.31 35.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.194 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.2 p -75.94 79.06 2.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.421 0.629 . . . . 0.0 111.169 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -144.95 144.85 31.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.199 -176.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.74 119.58 69.46 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 50.1 Cg_exo -54.77 -71.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.906 2.404 . . . . 0.0 112.822 -175.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.43 166.72 14.51 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.433 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.07 -41.2 97.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.957 0.408 . . . . 0.0 110.358 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.69 -37.1 81.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.509 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.62 -34.82 77.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.389 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -73.84 -12.07 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.48 177.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -93.15 -23.82 18.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.023 0.44 . . . . 0.0 110.221 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.9 mt -70.51 152.9 43.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.882 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -71.62 155.78 40.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.201 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HG3' HD22 ' A' ' 22' ' ' LEU . 1.8 mp0 -51.14 -49.68 60.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.363 0.414 . . . . 0.0 111.118 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.09 81.39 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.936 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.43 -38.94 74.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.021 0.439 . . . . 0.0 110.232 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.69 -38.33 80.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.175 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.433 ' HE3' ' HG3' ' A' ' 89' ' ' PRO . 82.8 mtp -63.41 -33.48 75.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.634 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -70.11 -38.31 75.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.812 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.82 -52.25 18.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.857 -177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -96.1 37.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.837 0.351 . . . . 0.0 110.579 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -43.44 -49.51 7.14 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -172.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -108.58 8.38 27.11 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.22 16.22 13.16 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.838 0.351 . . . . 0.0 110.227 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.432 ' O ' ' HD2' ' A' ' 90' ' ' PRO . 8.0 tt -126.42 146.54 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.322 -174.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HB2' ' A' ' 90' ' ' PRO . 59.5 t -134.53 120.8 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.054 0.454 . . . . 0.0 110.446 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.1 mt -89.79 105.47 16.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.707 177.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 92' ' ' ALA . 33.8 m -87.25 146.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.354 0.597 . . . . 0.0 111.271 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -91.4 117.69 5.25 Favored Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.816 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 28' ' ' ALA . 85.9 mt -95.1 7.26 46.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.764 0.426 . . . . 0.0 110.009 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 p -57.75 -30.61 65.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.712 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -73.45 -35.17 65.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.494 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' 96' ' ' LYS . 36.1 mt -104.76 99.23 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.28 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.37 -21.01 63.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.538 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -97.57 37.43 1.37 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.514 0.674 . . . . 0.0 110.885 -176.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.528 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.0 OUTLIER -83.39 16.28 2.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.929 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -67.23 -20.48 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.201 0.524 . . . . 0.0 110.455 178.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.96 -21.09 65.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.628 178.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 77' ' ' ILE . 13.3 tp -76.91 144.49 38.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.318 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -132.5 -172.47 2.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.402 -174.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 73' ' ' ARG . 19.0 mtp180 -100.86 129.57 46.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 173.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.41 33.82 6.99 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.053 -0.594 . . . . 0.0 111.879 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.56 163.45 12.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.014 0.435 . . . . 0.0 111.296 -175.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -120.7 112.62 19.09 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 170.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 71' ' ' LEU . 42.0 pt -125.16 151.88 31.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.453 0.644 . . . . 0.0 111.899 -176.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.422 ' HE3' ' CH2' ' A' ' 80' ' ' TRP . 35.8 ttpt -107.99 107.42 18.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.881 175.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 34.3 m -100.25 157.98 3.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.016 0.436 . . . . 0.0 111.472 -174.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.511 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 11.0 m-90 -124.62 129.64 50.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.047 175.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 4.4 p90 -151.09 161.82 42.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.585 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -128.49 -35.67 1.93 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.1 m -93.88 106.24 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.649 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -103.87 133.31 49.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.396 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -112.69 93.87 4.64 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.534 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 43.2 tt0 -92.77 89.61 6.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.219 0.533 . . . . 0.0 110.218 -177.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -103.23 -3.65 25.41 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.267 -175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 63.43 97.3 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.435 0 O-C-N 123.755 0.66 . . . . 0.0 110.535 -175.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 57.1 Cg_endo -70.28 150.18 91.03 Favored 'Cis proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.533 -1.445 . . . . 0.0 112.897 1.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.534 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.0 Cg_exo -61.13 146.3 97.76 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.024 2.483 . . . . 0.0 112.633 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.7 m -132.29 157.92 43.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.929 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.44 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -147.2 122.27 10.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.602 0.239 . . . . 0.0 111.224 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.4 m -84.23 110.56 18.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.5 pt -101.24 141.52 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.264 -174.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HB2' ' SD ' ' A' ' 13' ' ' MET . 95.7 mt-30 -96.75 -21.29 17.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.627 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.54 ' HA ' HD11 ' A' ' 65' ' ' ILE . 57.8 tttm -158.31 146.02 18.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.539 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 24.8 p90 -128.0 174.71 8.96 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -143.59 118.71 10.1 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.4 tp -73.46 127.8 33.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.481 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.2 mt . . . . . 0 C--N 1.322 -0.616 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.71 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 71.2 mtp . . . . . 0 N--CA 1.453 -0.286 0 CA-C-O 120.517 0.198 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -100.63 125.49 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.619 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 60.0 p -92.52 149.56 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.283 0.564 . . . . 0.0 112.0 -174.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -146.74 131.47 17.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.181 175.507 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.4 t -98.18 126.32 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 158.79 27.8 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.416 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.411 ' HE1' ' HA ' ' A' ' 34' ' ' THR . 97.6 m-85 -84.8 124.2 31.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.434 ' HA ' HD22 ' A' ' 30' ' ' LEU . 15.0 t -81.68 107.95 14.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.502 HG11 ' HG2' ' A' ' 37' ' ' PRO . 27.1 m -114.99 -41.29 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.737 0.303 . . . . 0.0 111.665 -176.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.739 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 71.7 mt -120.94 144.72 48.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 68' ' ' THR . 48.4 tttm -148.36 132.04 16.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 0.0 111.65 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -111.82 -165.19 0.97 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 169.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -90.19 -25.92 20.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.426 0.631 . . . . 0.0 109.542 174.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -94.15 -32.48 13.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.645 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -143.9 161.48 38.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 0.0 111.048 -171.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.554 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.63 127.35 31.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.711 173.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.739 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 37.6 mt -93.83 111.21 24.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -177.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 20' ' ' VAL . 23.8 mt -112.42 148.96 33.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.689 -174.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.2 mt -98.49 119.29 46.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 174.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 p -85.76 -14.37 45.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.141 0.495 . . . . 0.0 110.793 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -75.7 163.15 27.59 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.411 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.5 p -89.48 -11.85 41.76 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -76.69 105.58 7.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 0.0 110.695 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.98 137.58 61.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.209 176.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HG2' HG11 ' A' ' 21' ' ' VAL . 24.1 Cg_exo -63.61 151.5 84.77 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.087 2.524 . . . . 0.0 112.62 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.98 -175.62 39.49 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.932 177.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -51.75 -53.34 40.76 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.831 0.453 . . . . 0.0 111.621 -178.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 4.2 mp0 -67.97 -26.82 66.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.342 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -69.89 -35.23 74.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.678 0.275 . . . . 0.0 110.775 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -72.37 -18.44 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.962 0.41 . . . . 0.0 110.526 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.05 -22.09 25.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 98.9 mt -63.9 151.53 42.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.4 p -75.23 163.13 27.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.976 0.417 . . . . 0.0 111.109 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' A' ' 50' ' ' MET . 41.2 tt0 -53.35 -45.64 69.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.319 -177.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.88 -47.0 93.41 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.577 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -61.57 -40.21 93.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.682 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.48 -43.27 97.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.389 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.409 ' HE3' ' HG2' ' A' ' 46' ' ' GLU . 66.0 mtt -66.64 -24.65 66.33 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.239 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -85.76 -35.91 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.274 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -73.04 -37.67 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.911 0.386 . . . . 0.0 110.652 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -107.68 39.2 1.97 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.229 0.538 . . . . 0.0 109.906 176.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -52.85 121.72 7.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.936 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.5 t30 73.84 -7.47 1.59 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.844 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 56' ' ' ASN . 11.5 m120 -109.48 15.81 22.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.572 0.701 . . . . 0.0 110.106 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 21.0 tt -126.63 130.2 71.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.016 179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.507 HG22 ' HG2' ' A' ' 90' ' ' PRO . 95.2 t -115.44 128.83 72.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -172.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 91' ' ' SER . 57.4 mt -94.34 101.94 13.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.631 176.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.6 m -80.99 145.94 8.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.102 0.477 . . . . 0.0 110.639 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 114.54 4.32 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.308 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 28' ' ' ALA . 89.3 mt -98.76 13.74 31.22 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 177.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.0 t -61.48 -22.21 64.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.196 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -106.36 4.21 28.31 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.002 0.429 . . . . 0.0 110.709 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.8 mt -116.54 117.19 54.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.022 0.439 . . . . 0.0 110.608 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -92.14 -32.79 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 111.056 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -80.7 43.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.593 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . 0.521 ' O ' ' HE3' ' A' ' 23' ' ' LYS . 69.0 p -87.1 10.84 15.4 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 122.12 -0.363 . . . . 0.0 110.699 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.38 -36.09 60.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.849 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.37 -13.5 52.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.0 110.0 176.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.2 tp -79.28 100.74 7.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.654 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -106.22 148.12 28.29 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.598 -174.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.462 ' HD2' ' O ' ' A' ' 21' ' ' VAL . 15.4 ptt180 -91.52 152.35 20.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.906 0.384 . . . . 0.0 110.238 177.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.87 25.67 8.37 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -169.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.01 -164.44 2.02 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.972 0.415 . . . . 0.0 111.132 -173.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -131.47 141.55 49.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.243 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.8 pt -134.2 148.95 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.991 0.424 . . . . 0.0 110.945 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 50.0 tttp -103.31 106.83 17.44 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 175.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.1 m -97.17 147.09 6.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.498 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 16.0 m-90 -112.48 109.79 19.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.759 173.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.454 ' HB3' HG22 ' A' ' 94' ' ' ILE . 14.2 p90 -120.8 179.27 4.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -142.54 -38.72 0.36 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.36 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.5 m -110.41 121.72 45.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.68 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -108.87 132.97 53.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.24 0.543 . . . . 0.0 110.21 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -99.7 124.11 44.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.233 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -79.95 50.54 1.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.066 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -71.91 -29.29 64.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.585 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.4 t30 60.77 99.09 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 O-C-N 123.812 0.695 . . . . 0.0 111.268 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.83 153.31 79.86 Favored 'Cis proline' 0 C--N 1.344 0.341 0 C-N-CA 123.579 -1.425 . . . . 0.0 112.764 1.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' VAL . 12.5 Cg_endo -56.16 138.81 84.3 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.918 2.412 . . . . 0.0 112.536 -177.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 20.8 t -118.35 137.88 52.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.435 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -128.38 102.83 6.83 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.867 0.365 . . . . 0.0 111.077 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.9 m -68.99 112.23 5.49 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.467 HG21 ' HB ' ' A' ' 79' ' ' VAL . 34.4 pt -106.19 147.88 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.018 0.437 . . . . 0.0 111.022 -175.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -111.1 -25.29 9.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.44 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -142.16 137.56 30.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.251 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -140.03 153.6 46.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.92 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.469 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 40.8 tt0 -114.9 128.76 56.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.815 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.89 105.85 10.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.384 -178.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.0 mt . . . . . 0 C--N 1.325 -0.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.6 mtm . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -92.17 -25.82 18.51 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 172.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HE2' ' HB3' ' A' ' 3' ' ' LYS . 51.2 mtpt -84.94 88.93 7.48 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.417 172.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.42 135.41 57.42 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 176.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -45.97 125.59 6.48 Favored 'General case' 0 C--N 1.331 -0.235 0 O-C-N 123.677 0.611 . . . . 0.0 111.714 -176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.21 92.58 1.02 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.9 t30 -174.69 107.26 0.11 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.369 -173.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 104.35 27.17 6.25 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.68 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -80.75 143.57 32.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.662 -0.269 . . . . 0.0 110.487 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -72.23 -52.16 17.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.062 0.458 . . . . 0.0 109.911 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.0 m -87.62 89.52 8.02 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 121.288 0.566 . . . . 0.0 110.056 176.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -75.5 104.64 6.14 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.175 178.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 82.6 mtp -87.62 147.66 25.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 176.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -83.73 115.16 22.07 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.029 0.442 . . . . 0.0 109.988 -176.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.627 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.0 p -97.44 130.47 44.55 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.251 -176.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.6 OUTLIER -130.27 130.14 44.17 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.187 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.412 ' N ' HD13 ' A' ' 16' ' ' LEU . 50.8 t -95.54 123.51 47.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.22 -179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 176.61 27.29 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.706 -177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -101.24 134.84 43.68 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.66 0.267 . . . . 0.0 110.734 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.7 t -87.27 109.47 19.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 174.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 33.3 m -103.85 -36.76 4.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.103 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.737 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 89.6 mt -133.32 141.58 48.03 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.1 tttm -141.42 130.92 23.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.096 0.474 . . . . 0.0 111.624 -174.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -115.83 -146.44 0.4 Allowed 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 170.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -100.65 -55.73 2.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 118.029 0.377 . . . . 0.0 110.358 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -90.46 -6.74 54.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.578 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 66.9 mtt85 -151.1 155.03 38.09 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.053 0.454 . . . . 0.0 111.437 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -141.72 149.5 40.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.085 176.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.737 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 70.4 mt -105.21 116.37 48.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.866 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 mt -118.78 151.91 37.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.282 0.563 . . . . 0.0 111.71 -174.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.1 mt -101.68 116.66 45.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.937 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.5 p -84.9 0.12 52.22 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.982 0.42 . . . . 0.0 111.301 -176.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -95.69 -172.22 2.55 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.496 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 38.4 p -106.16 -2.29 22.7 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -174.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -86.27 124.19 32.36 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.841 0.353 . . . . 0.0 110.367 176.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.34 145.65 34.45 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.812 176.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 16.7 Cg_exo -68.29 165.99 26.84 Favored 'Trans proline' 0 C--O 1.234 0.29 0 C-N-CA 122.707 2.271 . . . . 0.0 112.44 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.4 176.61 37.09 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.19 178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -51.62 -47.64 63.58 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 122.539 0.336 . . . . 0.0 111.158 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.458 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 40.2 mt-10 -71.75 -26.24 62.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.532 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -67.1 -34.0 76.7 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.89 0.376 . . . . 0.0 110.201 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -74.27 -10.1 59.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.034 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -106.5 -5.11 19.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.877 0.37 . . . . 0.0 110.661 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 77.9 mt -74.54 163.78 27.35 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.796 176.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.493 ' HB2' ' HG3' ' A' ' 48' ' ' GLN . 16.3 m -76.18 149.25 37.31 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 174.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.461 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 1.6 mp0 -49.48 -51.17 37.78 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.533 0.521 . . . . 0.0 111.321 -176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.82 -39.08 94.93 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.985 -0.626 . . . . 0.0 112.623 -179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.493 ' HG3' ' HB2' ' A' ' 45' ' ' SER . 83.2 mt-30 -64.75 -41.89 95.58 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.996 0.427 . . . . 0.0 110.291 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 8.0 tt -66.98 -38.88 86.84 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.602 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.434 ' HA ' ' CD1' ' A' ' 57' ' ' ILE . 80.7 mtp -62.32 -40.86 97.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.189 178.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -72.66 -25.37 61.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.133 0.492 . . . . 0.0 110.875 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -81.57 -54.46 5.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.227 -176.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -92.71 23.88 3.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.012 0.434 . . . . 0.0 110.528 -178.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.421 ' HA ' HG22 ' A' ' 57' ' ' ILE . 86.2 tttt -50.94 -28.8 10.53 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.518 -176.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -66.27 -31.59 72.5 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 44.7 m-20 -143.57 28.86 1.43 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -173.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.463 HD11 ' CG2' ' A' ' 29' ' ' ILE . 15.1 tt -96.56 134.93 32.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.525 179.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.529 HG22 ' HG2' ' A' ' 90' ' ' PRO . 79.4 t -132.83 127.26 55.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.868 0.366 . . . . 0.0 110.354 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 63.9 mt -95.05 116.95 37.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 176.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.432 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 22.6 m -95.6 142.43 13.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.167 0.508 . . . . 0.0 111.68 -176.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.15 114.39 4.2 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.431 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 28' ' ' ALA . 88.3 mt -96.59 9.87 40.22 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 122.61 0.364 . . . . 0.0 110.787 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.7 p -59.9 -31.15 69.55 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.074 0.464 . . . . 0.0 111.203 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.654 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 2.9 mm-40 -79.19 -19.46 50.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.293 -177.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 65.3 mt -103.55 113.37 40.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.584 -175.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -102.15 31.95 3.72 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.758 0.789 . . . . 0.0 110.618 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -145.3 37.72 1.13 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.3 177.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.474 HG21 ' HB3' ' A' ' 62' ' ' LEU . 40.7 p -69.86 5.01 1.68 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.04 -15.58 58.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.631 0.253 . . . . 0.0 111.287 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -89.3 -4.67 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.08 0.466 . . . . 0.0 109.944 174.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.8 tp -81.68 116.49 21.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.979 176.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 60.5 mttm -99.51 130.4 45.76 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.727 -177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.4 ptt85 -90.23 142.47 27.69 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 90.8 19.06 45.2 Favored Glycine 0 N--CA 1.445 -0.725 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 -171.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 75' ' ' GLU . 6.1 mm-40 -134.67 -167.97 2.07 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.589 -0.306 . . . . 0.0 111.595 -171.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 88.3 tttt -127.76 138.77 52.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.924 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.523 HG22 HD12 ' A' ' 99' ' ' LEU . 38.3 pt -139.81 168.03 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 CA-C-O 121.505 0.669 . . . . 0.0 112.233 -178.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -123.93 106.88 10.79 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.829 177.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.0 m -101.6 147.51 8.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -173.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.581 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 6.0 m-90 -110.22 115.4 29.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.815 173.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 44.2 p90 -127.94 172.34 10.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.128 0.489 . . . . 0.0 111.008 178.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.6 t60 -155.95 -50.02 0.08 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.46 -0.791 . . . . 0.0 108.995 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.0 m -84.83 119.89 25.84 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.542 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 84' ' ' ARG . 13.9 ptt180 -139.13 153.03 47.92 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.938 0.399 . . . . 0.0 111.045 -176.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -120.64 106.43 11.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.71 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -86.96 97.94 10.98 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.14 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 19.8 m -112.27 -14.16 13.37 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.856 -175.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 60.73 93.59 0.06 OUTLIER Pre-proline 0 N--CA 1.467 0.411 0 O-C-N 123.479 0.487 . . . . 0.0 110.71 -172.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.45 ' HB3' HG23 ' A' ' 57' ' ' ILE . 14.7 Cg_exo -69.87 146.95 83.82 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.797 -1.335 . . . . 0.0 112.299 -1.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.529 ' HG2' HG22 ' A' ' 58' ' ' VAL . 62.0 Cg_endo -74.07 155.95 47.38 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.626 2.217 . . . . 0.0 112.783 -178.103 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 21.6 p -128.02 145.05 51.11 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.624 -0.717 . . . . 0.0 109.712 177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.432 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -129.95 128.54 42.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.681 0.277 . . . . 0.0 111.008 -177.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.3 m -87.29 113.71 23.25 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 29.3 pt -108.29 129.44 62.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.059 0.457 . . . . 0.0 110.7 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.654 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 82.9 mt-30 -101.33 -9.43 21.18 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.664 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 51.6 tttm -158.72 140.98 14.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -139.3 165.76 26.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.872 0.367 . . . . 0.0 111.047 178.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -125.11 117.24 23.48 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.523 HD12 HG22 ' A' ' 77' ' ' ILE . 37.1 tp -70.64 137.99 50.37 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.375 -177.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 76' ' ' LYS . 90.8 mt -112.45 -174.23 2.41 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 175.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 14.0 tp -153.18 148.0 26.4 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -176.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.67 -36.91 83.66 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.385 0.612 . . . . 0.0 110.183 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 51.4 t60 -72.8 -45.62 57.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.25 -176.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 53.1 t60 -142.79 125.79 16.26 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.61 0.243 . . . . 0.0 110.509 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -80.84 -43.65 19.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.467 -175.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.4 87.42 0.63 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.904 0.383 . . . . 0.0 110.187 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -62.62 137.95 58.38 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.313 -173.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 40.9 m80 . . . . . 0 C--O 1.247 0.922 0 CA-C-O 118.465 -0.779 . . . . 0.0 109.464 178.458 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 120.729 0.299 . . . . 0.0 110.456 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 44.2 t-20 -116.86 75.45 0.97 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -113.46 98.85 7.34 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.51 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 42.6 t-20 -73.39 114.64 11.83 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 173.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -62.33 -45.98 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.555 -173.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 53.55 36.46 23.43 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.629 0.58 . . . . 0.0 110.562 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -100.33 129.3 46.3 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.67 -174.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 166.58 -142.03 7.34 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.995 178.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -70.68 -27.97 64.42 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.91 0.386 . . . . 0.0 110.946 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.11 -36.48 77.55 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.17 175.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.3 55.49 2.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.125 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 44.0 tttp -136.45 109.72 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 110.282 -178.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 61.9 mtm -102.7 152.14 21.56 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.698 -177.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -85.42 120.08 26.5 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.14 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.409 ' HG ' ' HE1' ' A' ' 80' ' ' TRP . 7.9 m -96.44 128.45 43.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.502 -174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.441 HD12 ' CE1' ' A' ' 81' ' ' PHE . 11.6 mt -130.21 160.02 35.09 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.788 173.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.7 t -127.57 126.93 68.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 174.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.58 166.69 29.19 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.08 -1.057 . . . . 0.0 112.797 -176.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 81.6 m-85 -104.76 132.89 50.46 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.745 0.307 . . . . 0.0 110.285 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.534 HG21 HD11 ' A' ' 71' ' ' LEU . 12.0 t -89.15 100.65 11.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.8 m -92.12 -40.43 12.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.53 -177.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 99.0 mt -127.78 141.14 51.66 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.916 -178.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -126.39 136.25 52.45 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.759 178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.718 ' HB3' ' HG3' ' A' ' 27' ' ' ARG . 7.7 t70 -135.92 -167.15 1.98 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 -179.407 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -79.49 106.96 11.9 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 110.388 -0.227 . . . . 0.0 110.388 -176.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 71.41 7.99 6.18 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.324 0.65 . . . . 0.0 111.841 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.718 ' HG3' ' HB3' ' A' ' 24' ' ' ASP . 32.9 ptt180 -146.46 140.21 26.09 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 120.798 0.332 . . . . 0.0 110.398 -176.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.5 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -128.65 142.57 50.99 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.435 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.81 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 60.4 mt -97.68 107.07 19.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.685 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.104 179.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD11 HG22 ' A' ' 20' ' ' VAL . 4.0 mm? -102.15 147.28 26.81 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.959 -176.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.435 ' HA ' ' O ' ' A' ' 56' ' ' ASN . 20.0 mt -106.31 123.71 61.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.076 173.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 20.5 p -81.71 -7.97 59.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.54 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -73.21 156.22 38.77 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 175.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 21.2 p -100.04 12.8 36.0 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -168.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.8 tttm -125.81 144.11 50.78 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.838 -0.43 . . . . 0.0 109.838 171.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.9 137.82 79.65 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 173.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.54 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 56.4 Cg_endo -69.99 177.38 5.79 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.474 2.116 . . . . 0.0 112.318 -178.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -79.19 169.72 54.09 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.531 -0.843 . . . . 0.0 111.753 -179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.1 tptt -66.31 -27.01 67.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 37.4 mp0 -62.6 -42.49 99.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.376 176.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 14.2 m-20 -67.0 -35.27 79.56 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.433 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -69.6 -23.48 63.53 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.91 175.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -87.29 -15.37 38.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.423 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.7 mt -71.48 173.11 8.38 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.459 178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.8 m -103.04 177.42 4.84 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.49 178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.62 -47.54 81.91 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.073 -178.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.91 -33.15 72.39 Favored Glycine 0 CA--C 1.517 0.198 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.635 -179.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.5 ' HB3' HD13 ' A' ' 44' ' ' LEU . 78.8 mm-40 -65.07 -51.84 59.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.771 0.32 . . . . 0.0 110.63 178.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 82.3 mt -67.6 -31.38 71.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.491 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.613 ' HG3' ' HG3' ' A' ' 89' ' ' PRO . 47.9 ttm -63.01 -33.61 75.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.229 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -87.31 -44.62 11.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.224 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -69.82 -54.47 13.41 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.358 -176.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.445 ' O ' HG22 ' A' ' 57' ' ' ILE . 99.4 m-85 -99.03 46.09 0.99 Allowed 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.2 tttp -52.15 -35.4 48.49 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.768 -170.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.405 HD22 ' HA ' ' A' ' 55' ' ' ASN . 12.1 m120 -111.67 14.45 21.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.823 0.344 . . . . 0.0 111.425 -177.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 31' ' ' ILE . 18.6 m120 -122.88 -4.52 8.59 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.811 178.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.445 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.2 tt -97.47 116.36 39.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.531 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.516 HG22 ' HB2' ' A' ' 90' ' ' PRO . 88.4 t -120.88 116.28 49.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.362 177.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.551 HG12 HG12 ' A' ' 29' ' ' ILE . 59.9 mt -85.32 104.72 13.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 175.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.414 HG12 ' HB3' ' A' ' 92' ' ' ALA . 34.9 m -93.92 141.29 15.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.167 0.508 . . . . 0.0 111.421 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.37 130.62 9.82 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.589 176.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' HG21 ' A' ' 68' ' ' THR . 41.2 mt -105.61 7.74 32.89 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 124.177 0.575 . . . . 0.0 110.189 -178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.6 m -59.74 -28.56 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.724 0.638 . . . . 0.0 112.724 -172.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -95.07 -14.03 24.63 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.559 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 55.9 mt -107.34 104.28 16.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.73 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -77.53 -23.12 50.22 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.118 -177.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -85.55 41.04 0.87 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.222 0.534 . . . . 0.0 111.089 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.537 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.8 p -96.07 15.19 21.4 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.896 177.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -41.9 93.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.13 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.81 1.73 37.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.17 -176.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.534 HD11 HG21 ' A' ' 20' ' ' VAL . 42.7 tp -77.11 121.18 23.23 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.485 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 30.4 mttp -120.69 -172.46 2.38 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.457 -175.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 73' ' ' ARG . 52.2 mtt180 -98.05 134.56 40.97 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 173.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 88.26 26.39 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.687 -178.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 72' ' ' LYS . 9.8 mm-40 -103.5 174.39 5.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.016 0.436 . . . . 0.0 110.51 -176.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -132.14 127.77 36.65 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 176.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.473 HG22 ' HA ' ' A' ' 99' ' ' LEU . 37.4 pt -137.25 155.01 31.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 121.426 0.631 . . . . 0.0 112.037 -176.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.458 ' HB2' HD11 ' A' ' 100' ' ' LEU . 86.0 tttt -106.95 114.8 29.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.574 173.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 22.6 m -104.56 139.5 25.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.283 0.563 . . . . 0.0 111.944 -173.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.409 ' HE1' ' HG ' ' A' ' 15' ' ' SER . 4.8 m-90 -109.4 122.82 48.21 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.118 170.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.441 ' CE1' HD12 ' A' ' 16' ' ' LEU . 2.0 p90 -149.06 177.13 9.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.073 0.463 . . . . 0.0 110.912 -178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -144.79 -42.01 0.24 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.824 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 7.3 m -82.5 104.76 13.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.163 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.6 ttm-85 -98.76 117.35 33.05 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -99.2 115.39 28.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.239 0.543 . . . . 0.0 110.523 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.23 90.97 4.33 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.259 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -98.29 -31.11 12.22 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.873 175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 66.0 t30 51.83 90.46 0.08 OUTLIER Pre-proline 0 N--CA 1.467 0.403 0 O-C-N 124.015 0.822 . . . . 0.0 110.715 -175.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.613 ' HG3' ' HG3' ' A' ' 50' ' ' MET . 36.7 Cg_endo -62.37 151.4 63.99 Favored 'Cis proline' 0 C--N 1.354 0.842 0 C-N-CA 124.762 -0.932 . . . . 0.0 114.16 7.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.516 ' HB2' HG22 ' A' ' 58' ' ' VAL . 51.6 Cg_exo -54.35 144.03 62.81 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.602 2.868 . . . . 0.0 113.911 -174.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 35.1 t -130.48 164.31 25.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.579 176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.414 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.25 170.43 22.28 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.697 0.284 . . . . 0.0 110.484 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 49.9 m -126.66 117.32 22.51 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 27.0 pt -89.46 141.82 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 120.032 -0.667 . . . . 0.0 111.439 -173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -95.46 -35.07 11.85 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.908 -178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.0 tttp -158.75 149.19 19.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.398 175.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' OH ' ' HA ' ' A' ' 68' ' ' THR . 13.2 p90 -138.93 143.71 38.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.257 177.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -114.68 129.41 56.68 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.359 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.473 ' HA ' HG22 ' A' ' 77' ' ' ILE . 57.3 tp -76.17 122.47 24.39 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.621 -178.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 78' ' ' LYS . 87.3 mt -112.11 84.09 1.91 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.426 ' HG ' ' H ' ' A' ' 103' ' ' HIS . 42.3 tp -82.98 155.88 23.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.32 -177.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -59.22 -26.33 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.255 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.426 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 24.8 m80 -114.79 139.68 49.53 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.164 177.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.0 m-70 -78.79 -31.43 46.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.915 -176.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -115.66 159.18 21.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.082 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -67.46 -42.53 82.89 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.523 -175.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -135.11 -174.29 3.57 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 0.0 110.768 -177.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 . . . . . 0 C--O 1.246 0.877 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.067 -177.179 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.2 mtt . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 120.524 0.202 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.4 t30 60.14 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -166.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.558 ' HE3' ' O ' ' A' ' 6' ' ' GLN . 57.3 tttp -92.92 105.57 17.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.985 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -67.49 117.43 9.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.567 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 64.29 -163.18 0.27 Allowed 'General case' 0 C--O 1.233 0.2 0 O-C-N 123.666 0.604 . . . . 0.0 109.805 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.558 ' O ' ' HE3' ' A' ' 3' ' ' LYS . 50.1 tt0 -103.47 -43.32 5.43 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.088 0.47 . . . . 0.0 109.968 177.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -123.75 111.69 16.45 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.202 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -78.91 178.28 53.59 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.335 -179.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -90.36 143.68 26.53 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -78.53 -29.29 46.41 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.628 -178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.2 m -70.77 115.83 10.37 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.393 -178.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -85.61 143.07 28.66 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.532 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.549 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 65.8 mtm -80.27 140.01 36.4 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.882 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -85.43 116.74 23.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.911 0.386 . . . . 0.0 110.17 -179.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.4 m -84.9 125.63 32.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.227 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.461 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 3.0 tm? -116.67 120.2 37.88 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 177.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.5 t -98.51 123.71 51.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.143 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -157.36 169.59 34.37 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.854 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -105.55 140.9 37.93 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 122.246 0.218 . . . . 0.0 110.52 178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.562 HG21 HD11 ' A' ' 71' ' ' LEU . 22.6 t -87.76 113.92 25.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.2 m -110.64 -41.33 4.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 120.718 -0.393 . . . . 0.0 111.192 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.7 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 95.7 mt -134.02 160.17 38.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.814 0.34 . . . . 0.0 110.416 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -148.43 162.3 39.87 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.826 179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -156.68 -164.68 1.7 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 175.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -75.81 -47.74 24.49 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 111.336 -175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -82.37 -45.89 14.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.861 -176.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.684 ' HG2' ' HA2' ' A' ' 61' ' ' GLY . 33.1 mtm180 -138.71 163.3 32.5 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.569 -169.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.42 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -116.12 152.49 33.55 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.314 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.7 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 58.6 mt -109.32 113.99 45.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.075 0.464 . . . . 0.0 110.787 -176.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.53 HD13 HD11 ' A' ' 77' ' ' ILE . 66.9 mt -113.78 144.16 43.45 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.934 -176.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 56.3 mt -102.9 120.66 53.04 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -85.26 -7.58 58.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.095 0.474 . . . . 0.0 111.1 -177.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 10.2 t70 -89.79 158.93 17.28 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.645 178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 44.7 p -97.6 2.6 50.12 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -175.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -81.82 110.37 17.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 173.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.49 131.84 70.56 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.206 -175.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.35 160.39 47.94 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.845 2.363 . . . . 0.0 112.032 178.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.54 179.58 35.99 Favored Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.144 -178.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.48 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 7.9 tmtm? -57.94 -41.42 82.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.851 0.358 . . . . 0.0 110.542 -177.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.03 -27.51 64.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.235 -178.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -66.08 -33.93 76.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.93 0.395 . . . . 0.0 109.967 176.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.45 -14.23 61.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -89.29 -22.18 22.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.009 0.433 . . . . 0.0 109.956 175.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.1 mt -69.73 153.07 43.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.665 178.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.9 p -82.93 165.66 19.54 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.151 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 50' ' ' MET . 36.2 mp0 -48.72 -50.98 31.16 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.709 -179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.13 -48.99 83.25 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.748 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -64.02 -32.26 73.75 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.636 0.255 . . . . 0.0 111.142 -179.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.8 tp -67.34 -41.85 84.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.971 0.415 . . . . 0.0 110.117 177.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.534 ' HG2' HD13 ' A' ' 57' ' ' ILE . 65.0 mtt -65.7 -32.01 73.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -66.43 -36.03 81.78 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.867 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -82.81 -54.49 5.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.135 -176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -91.32 41.34 1.06 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.343 0.592 . . . . 0.0 110.238 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 77.9 tttt -60.79 124.99 22.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.344 -0.843 . . . . 0.0 110.607 -177.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 4.5 m-20 72.99 4.86 5.08 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 123.917 0.761 . . . . 0.0 111.256 -179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.518 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 13.6 m120 -118.63 11.91 12.96 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.534 HD13 ' HG2' ' A' ' 50' ' ' MET . 13.2 tt -129.06 134.2 64.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.196 -176.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 82.1 t -124.38 132.72 70.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.459 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.434 ' O ' ' HA ' ' A' ' 91' ' ' SER . 29.8 mt -98.94 104.9 16.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.645 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 21.9 m -94.21 128.87 45.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.32 0.581 . . . . 0.0 111.297 -176.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.684 ' HA2' ' HG2' ' A' ' 27' ' ' ARG . . . -80.33 122.06 5.63 Favored Glycine 0 N--CA 1.443 -0.893 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.669 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.42 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.7 mt -88.43 31.57 0.82 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.131 0.491 . . . . 0.0 110.061 -178.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.4 m -63.69 -26.17 68.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.632 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.419 ' HA ' ' OE1' ' A' ' 64' ' ' GLU . 3.6 tp10 -105.26 -3.08 23.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.401 0.619 . . . . 0.0 110.081 177.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 28.7 mm -122.62 91.05 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.997 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -98.21 18.09 17.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 122.08 0.943 . . . . 0.0 109.913 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -121.15 14.39 11.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.493 -173.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 32.52 0.26 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -171.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -89.49 -14.66 34.8 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.363 0.601 . . . . 0.0 109.717 177.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -81.8 -28.52 33.14 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.451 175.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.562 HD11 HG21 ' A' ' 20' ' ' VAL . 12.6 tp -57.36 123.29 14.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.806 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 64.4 mttm -104.73 170.74 7.7 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.988 0.423 . . . . 0.0 111.165 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 43.8 mtt85 -87.22 143.3 27.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.24 -0.437 . . . . 0.0 109.979 176.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 77.58 42.0 18.74 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.46 -0.656 . . . . 0.0 111.46 -178.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -124.28 -174.88 3.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.221 0.534 . . . . 0.0 112.017 -176.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.493 ' H ' ' HE1' ' A' ' 105' ' ' HIS . 56.7 tttm -135.2 125.2 25.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.712 -175.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.63 HD13 HG13 ' A' ' 79' ' ' VAL . 2.6 pp -135.6 171.47 17.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.488 0.661 . . . . 0.0 112.708 -174.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -135.15 111.73 9.93 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.712 -1.131 . . . . 0.0 108.697 174.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.63 HG13 HD13 ' A' ' 77' ' ' ILE . 27.8 m -107.29 156.02 7.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-O 120.816 0.341 . . . . 0.0 111.208 -176.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.549 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 9.8 m-90 -122.69 130.59 53.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.838 175.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.569 ' HB3' ' HA ' ' A' ' 94' ' ' ILE . 44.5 p90 -148.33 -178.34 6.26 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.986 0.422 . . . . 0.0 111.034 179.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 69.5 m-70 -140.99 -45.06 0.39 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.02 175.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.3 m -82.94 117.76 23.0 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.126 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 49.9 ptt85 -139.61 155.04 47.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.758 0.313 . . . . 0.0 110.58 176.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -122.34 128.98 51.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.372 177.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -90.52 59.49 4.3 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.42 0.628 . . . . 0.0 110.139 175.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -79.12 -22.27 45.41 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.697 177.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.468 HD22 ' N ' ' A' ' 88' ' ' ASN . 0.8 OUTLIER 68.69 102.06 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.495 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.811 179.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.481 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 16.3 Cg_exo -69.0 146.8 81.63 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.829 -1.321 . . . . 0.0 112.194 -0.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 29.9 Cg_exo -61.26 137.56 71.5 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.837 2.358 . . . . 0.0 112.624 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.434 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 14.6 m -115.93 145.97 42.47 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.146 176.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -147.41 128.95 15.02 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.588 -176.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 46.7 m -83.41 112.77 20.24 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.569 ' HA ' ' HB3' ' A' ' 81' ' ' PHE . 40.9 pt -87.04 149.85 3.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.105 0.479 . . . . 0.0 111.287 -176.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -103.65 -48.09 4.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.32 -178.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -138.48 163.97 30.58 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.05 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.524 ' HB2' HG12 ' A' ' 79' ' ' VAL . 6.2 p90 -164.23 159.06 19.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.665 0.269 . . . . 0.0 110.725 177.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -121.01 132.75 55.09 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.711 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.564 ' HA ' HG22 ' A' ' 77' ' ' ILE . 38.4 tp -82.1 108.98 16.0 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.963 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.96 94.38 9.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.406 0.622 . . . . 0.0 109.858 -179.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 23.2 tp -81.92 89.16 6.35 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.639 -175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.566 ' HB2' ' CD2' ' A' ' 105' ' ' HIS . 37.1 mt-10 -63.61 163.76 10.73 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.37 177.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 28.3 t60 -64.96 -28.42 69.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 169.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 24.5 m170 -54.91 -32.51 61.15 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.79 172.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . 0.644 ' HA ' ' CE1' ' A' ' 108' ' ' HIS . 14.0 m170 -81.88 -8.21 59.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.707 -172.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -76.87 -25.15 52.78 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.17 -177.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -146.06 99.32 3.23 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.644 ' CE1' ' HA ' ' A' ' 105' ' ' HIS . 28.2 p-80 . . . . . 0 C--O 1.249 1.027 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 167.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.437 ' HB3' ' H ' ' A' ' 2' ' ' ASN . 80.8 mmm . . . . . 0 N--CA 1.48 1.04 0 CA-C-O 120.527 0.203 . . . . 0.0 110.865 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.437 ' H ' ' HB3' ' A' ' 1' ' ' MET . 21.1 p-10 -74.81 14.35 0.52 Allowed 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -170.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.785 ' HB2' ' HG3' ' A' ' 5' ' ' GLU . 93.4 mttt -98.7 4.03 47.79 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 173.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 62.31 36.51 14.54 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.417 0.627 . . . . 0.0 109.918 -175.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.785 ' HG3' ' HB2' ' A' ' 3' ' ' LYS . 12.9 mt-10 -70.93 147.68 48.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.892 -1.049 . . . . 0.0 112.199 -173.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -80.25 -43.22 21.76 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.3 -0.863 . . . . 0.0 109.209 172.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -110.03 138.83 45.86 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.373 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 153.16 -57.48 0.42 Allowed Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.595 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -99.28 -87.35 0.36 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.498 0.189 . . . . 0.0 111.499 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 61.89 11.09 3.91 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.123 0.569 . . . . 0.0 111.621 -174.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.5 p -88.36 131.34 34.87 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.328 179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -73.9 126.5 30.59 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.899 0.38 . . . . 0.0 110.295 -178.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.43 ' SD ' ' HD2' ' A' ' 96' ' ' LYS . 83.2 mtp -119.89 156.25 31.12 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.813 -179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -83.26 121.81 27.6 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.762 0.315 . . . . 0.0 110.4 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.2 m -82.74 125.36 31.17 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.074 -176.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.487 ' O ' HG22 ' A' ' 79' ' ' VAL . 2.7 tm? -138.72 120.59 15.42 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.9 p -89.97 139.16 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -149.61 145.5 13.75 Favored Glycine 0 N--CA 1.445 -0.742 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.18 -177.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.864 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 87.5 m-85 -91.61 121.14 33.01 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.443 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 40.0 t -75.82 93.57 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.48 -38.13 7.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.094 -178.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.793 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 93.2 mt -121.91 124.75 44.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.155 0.503 . . . . 0.0 110.19 178.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 44.5 tttm -124.61 119.05 27.91 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.936 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 59.4 m-20 -118.47 13.61 13.53 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.121 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 75.08 -55.08 0.65 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.933 -1.03 . . . . 0.0 111.922 175.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -85.24 -36.77 20.71 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 27' ' ' ARG . 43.1 mtp180 -113.39 148.36 35.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.759 176.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.569 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -138.69 130.81 28.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.02 0.438 . . . . 0.0 110.62 175.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.793 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 66.8 mt -104.34 115.78 46.89 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.443 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.4 mt -114.47 147.18 39.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.125 -174.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 66.5 mt -101.89 129.12 53.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 168.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.5 p -53.93 -58.61 6.65 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.77 0.319 . . . . 0.0 111.005 -178.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.864 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 35.4 t70 -164.71 140.4 5.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.52 0.676 . . . . 0.0 111.952 174.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.3 m -146.97 17.11 1.23 Allowed 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 170.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm 48.25 64.02 1.83 Allowed 'General case' 0 C--O 1.231 0.119 0 CA-C-N 114.483 -1.235 . . . . 0.0 110.975 -172.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.412 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 61.58 96.43 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.195 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.994 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 24.7 Cg_endo -62.73 167.73 11.33 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.774 2.316 . . . . 0.0 111.998 178.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -92.18 167.0 30.01 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.978 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -62.97 -28.97 70.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.224 -178.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.412 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 39.4 tt0 -66.06 -33.58 76.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.547 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -69.86 -34.03 73.05 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -73.87 -19.24 60.78 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.868 175.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -78.69 -30.92 46.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.357 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 90.8 mt -63.3 142.91 58.21 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.351 179.012 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.2 m -76.0 168.91 19.17 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.404 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -49.53 -49.55 45.62 Favored 'General case' 0 C--N 1.331 -0.203 0 O-C-N 123.495 0.497 . . . . 0.0 111.537 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.6 -45.62 95.99 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.22 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.8 mt-30 -65.73 -41.49 92.18 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.969 0.414 . . . . 0.0 110.675 -178.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.5 tp -63.13 -43.52 98.15 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.165 177.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 45.9 ttm -67.21 -34.35 77.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.342 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 m-80 -71.7 -24.65 61.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.709 0.29 . . . . 0.0 111.245 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -89.88 -54.84 3.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.951 0.405 . . . . 0.0 110.777 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -97.4 40.17 1.17 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.639 -177.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -54.84 -34.99 63.51 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.417 -173.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -92.37 -5.34 52.31 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.678 0.275 . . . . 0.0 111.422 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -121.48 3.17 10.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.6 tt -96.28 121.91 47.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.327 0.584 . . . . 0.0 110.834 -178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.8 t -124.48 121.98 62.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.075 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 91' ' ' SER . 60.3 mt -91.76 105.85 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 34.1 m -98.75 150.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-O 121.264 0.554 . . . . 0.0 111.296 -175.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.53 126.58 8.68 Favored Glycine 0 N--CA 1.441 -1.033 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.841 178.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.577 ' HB3' HG21 ' A' ' 68' ' ' THR . 85.4 mt -100.72 19.0 17.89 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.182 0.515 . . . . 0.0 109.853 178.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 2.1 m -61.27 -29.91 70.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.583 -176.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.65 -51.47 11.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.392 . . . . 0.0 111.281 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 49.1 mt -89.28 108.68 19.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.469 -176.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.22 12.13 19.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.824 0.345 . . . . 0.0 111.227 -177.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -112.89 34.52 4.37 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.304 0.573 . . . . 0.0 109.572 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.577 HG21 ' HB3' ' A' ' 62' ' ' LEU . 5.8 p -89.3 2.53 54.21 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -80.22 -11.32 59.75 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 119.975 -0.69 . . . . 0.0 109.944 178.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.37 -25.03 63.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.295 172.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.26 158.61 28.51 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.536 174.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 31.8 tttp -142.86 154.45 44.15 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.722 178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -72.51 118.07 14.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.155 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 106.2 22.69 7.73 Favored Glycine 0 N--CA 1.447 -0.614 0 N-CA-C 111.136 -0.785 . . . . 0.0 111.136 -175.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -113.48 165.08 12.82 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 -175.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -127.42 124.39 38.37 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.922 0.392 . . . . 0.0 110.554 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 99' ' ' LEU . 39.5 pt -130.24 153.14 38.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.782 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE3' ' CZ2' ' A' ' 80' ' ' TRP . 35.9 ttpt -111.8 110.66 21.14 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.487 HG22 ' O ' ' A' ' 16' ' ' LEU . 8.6 m -99.6 159.23 3.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 121.286 0.565 . . . . 0.0 111.869 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.431 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 20.9 m-90 -127.77 128.41 45.29 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.467 173.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -134.83 175.17 9.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.155 176.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -95.81 -37.75 10.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.161 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 13.1 t -154.71 157.19 37.7 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.535 ' HA ' ' HB2' ' A' ' 92' ' ' ALA . 50.7 ttp180 -121.39 134.92 55.12 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 178.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -88.11 125.26 34.49 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.951 0.405 . . . . 0.0 110.376 -177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -80.83 74.52 7.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.209 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -86.68 -24.3 25.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.899 -178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 33.4 t30 61.09 92.17 0.07 OUTLIER Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.685 -174.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.44 156.75 96.76 Favored 'Cis proline' 0 C--N 1.345 0.355 0 C-N-CA 123.635 -1.402 . . . . 0.0 112.392 -0.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.11 139.88 92.56 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.863 2.375 . . . . 0.0 112.662 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 18.1 p -135.31 142.75 45.89 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.353 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.535 ' HB2' ' HA ' ' A' ' 84' ' ' ARG . . . -158.28 139.06 12.93 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.706 0.289 . . . . 0.0 111.19 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.3 m -81.17 115.77 20.75 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 175.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 28.4 pt -86.31 135.83 24.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.123 0.487 . . . . 0.0 110.488 -178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -106.05 -22.89 12.77 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.979 -174.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' HD2' ' SD ' ' A' ' 13' ' ' MET . 65.2 mttp -142.88 147.34 35.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.915 177.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.487 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -152.81 156.77 39.7 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.987 0.423 . . . . 0.0 110.677 171.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -114.84 112.0 22.09 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 173.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.565 ' HA ' HG22 ' A' ' 77' ' ' ILE . 6.1 tt -72.31 113.31 9.21 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 87.9 mt -69.31 118.18 11.87 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.201 -172.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.92 96.59 0.06 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.017 -0.992 . . . . 0.0 111.23 -179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -59.08 125.7 24.67 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.512 176.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -57.32 -47.92 80.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.126 -176.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 11.8 m170 57.68 81.13 0.15 Allowed 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 112.885 0.698 . . . . 0.0 112.885 172.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -87.15 -16.25 35.96 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -93.82 100.96 13.05 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 160.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -95.62 114.63 26.4 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -166.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 . . . . . 0 C--O 1.241 0.647 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.327 168.079 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttp . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 111.293 0.109 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 20.7 t30 -134.01 -14.72 2.35 Favored 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.419 ' HB2' ' OE2' ' A' ' 5' ' ' GLU . 99.4 mttt -92.44 8.63 37.81 Favored 'General case' 0 C--N 1.328 -0.336 0 O-C-N 121.967 -0.458 . . . . 0.0 111.178 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 57.79 75.83 0.36 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.201 0.524 . . . . 0.0 109.72 -174.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.419 ' OE2' ' HB2' ' A' ' 3' ' ' LYS . 60.1 mp0 -87.46 -46.83 9.26 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.447 -175.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -87.21 111.04 20.6 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.074 0.464 . . . . 0.0 110.624 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -137.54 173.13 12.0 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.785 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.1 2.64 51.59 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.545 -178.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -130.1 110.22 11.44 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -126.62 -41.44 1.85 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.65 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 15.9 m -65.03 96.97 0.21 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.529 178.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -115.53 107.2 14.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.339 -179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.505 ' HE1' ' HB2' ' A' ' 95' ' ' GLN . 75.4 mtp -86.21 172.0 10.85 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.469 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 85.1 mm-40 -83.76 115.19 22.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.089 0.471 . . . . 0.0 109.865 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.6 t -96.93 129.9 44.31 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.296 -0.865 . . . . 0.0 111.222 -172.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.9 137.37 29.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.7 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 62.1 t -97.68 137.76 24.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 178.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 32' ' ' THR . . . -148.62 154.5 25.88 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.453 -0.879 . . . . 0.0 112.432 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 30.8 m-85 -88.7 127.14 35.58 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.148 -0.316 . . . . 0.0 110.148 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.436 ' HA ' HD22 ' A' ' 30' ' ' LEU . 10.9 t -83.02 102.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 179.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.1 p -120.51 -49.41 3.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.608 ' HB3' ' HB ' ' A' ' 29' ' ' ILE . 25.8 tp -122.7 138.76 54.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.773 0.32 . . . . 0.0 110.855 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.9 mttp -131.06 162.87 28.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.869 0.366 . . . . 0.0 110.781 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -123.05 -69.87 0.8 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.351 171.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -166.09 -75.24 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.936 176.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -93.8 -15.43 25.13 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.243 0.544 . . . . 0.0 110.268 178.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.403 HH11 ' HD3' ' A' ' 27' ' ' ARG . 14.6 ptt180 -116.49 141.37 48.26 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.811 175.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.41 145.94 47.4 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.425 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.608 ' HB ' ' HB3' ' A' ' 22' ' ' LEU . 66.6 mt -107.33 108.17 24.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.963 -179.143 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 20' ' ' VAL . 58.8 mt -116.06 149.8 38.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.981 -174.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.467 HD12 ' HG3' ' A' ' 37' ' ' PRO . 54.6 mt -109.26 122.05 63.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 174.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.402 ' HA ' ' HA2' ' A' ' 18' ' ' GLY . 23.9 p -94.3 7.56 44.96 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -171.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CG ' ' H ' ' A' ' 34' ' ' THR . 31.9 t70 -163.58 -162.73 0.75 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.581 ' HG1' ' HE1' ' A' ' 53' ' ' PHE . 6.5 m 82.15 23.07 0.23 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.686 0.795 . . . . 0.0 111.854 175.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 48.0 tttm 56.8 42.52 26.5 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.414 169.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.63 134.36 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.543 -178.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.467 ' HG3' HD12 ' A' ' 31' ' ' ILE . 45.1 Cg_exo -56.25 136.58 76.07 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.826 2.351 . . . . 0.0 112.107 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.63 -163.34 30.3 Favored Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.713 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -52.64 -58.29 7.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.859 0.464 . . . . 0.0 111.89 -176.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -68.34 -27.29 66.14 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.754 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -67.76 -30.55 70.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.83 0.348 . . . . 0.0 110.648 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -83.49 -1.77 54.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.845 0.355 . . . . 0.0 111.06 175.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -110.6 -10.97 14.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.925 -179.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 93.1 mt -79.6 149.15 31.43 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.031 0.443 . . . . 0.0 111.248 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.7 m -88.77 -178.93 5.89 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.242 174.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -55.2 -60.84 2.83 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.03 -33.97 86.1 Favored Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 121.165 -0.541 . . . . 0.0 112.569 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -71.49 -37.26 71.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.027 0.442 . . . . 0.0 110.362 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.3 tp -64.97 -42.77 94.28 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.566 176.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 80.4 mtp -66.77 -23.64 66.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.922 177.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -74.95 -42.24 58.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.856 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -77.17 -45.71 25.77 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.137 0.494 . . . . 0.0 110.668 179.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.581 ' HE1' ' HG1' ' A' ' 34' ' ' THR . 89.2 m-85 -98.81 44.65 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -175.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -44.09 -39.2 4.07 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 -177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -121.29 9.81 10.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.555 -176.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -120.22 -5.45 9.94 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -177.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.542 HG22 ' O ' ' A' ' 53' ' ' PHE . 13.8 tt -99.37 132.06 45.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.928 0.394 . . . . 0.0 109.955 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 63.5 t -122.97 126.97 74.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.945 0.403 . . . . 0.0 110.617 -178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 61.6 mt -96.72 100.91 11.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 27.6 m -89.1 141.99 13.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-O 121.124 0.488 . . . . 0.0 111.374 -175.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.77 115.33 4.63 Favored Glycine 0 N--CA 1.441 -0.996 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.18 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 28' ' ' ALA . 80.4 mt -94.47 27.09 3.11 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.927 0.394 . . . . 0.0 110.123 -178.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.5 m -55.57 -35.84 66.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.89 -175.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.455 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 14.8 mm-40 -81.87 -6.91 59.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 111.092 -176.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 45.3 mm -114.32 99.91 9.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -68.45 -41.06 80.78 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.414 -174.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -107.01 106.75 17.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.929 0.395 . . . . 0.0 110.737 -178.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 46.5 p -98.3 18.58 16.05 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.425 0.631 . . . . 0.0 109.517 175.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.39 -29.83 70.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.304 -171.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -81.28 -17.81 48.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.841 0.353 . . . . 0.0 111.162 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.7 mt -71.5 125.06 26.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.908 0.385 . . . . 0.0 110.568 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -106.68 -172.59 2.11 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.878 -176.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 73' ' ' ARG . 15.8 ttt180 -111.36 126.01 54.47 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.001 0.429 . . . . 0.0 110.373 177.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 33.65 5.36 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.781 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -115.09 179.58 3.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.014 0.435 . . . . 0.0 111.103 -178.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.484 ' HD2' ' HG2' ' A' ' 102' ' ' GLU . 48.9 mttp -129.44 129.6 44.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.397 176.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.57 HG22 ' HA ' ' A' ' 99' ' ' LEU . 30.1 pt -130.84 145.13 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.019 0.438 . . . . 0.0 111.275 179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.564 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 8.1 ttpm? -106.34 107.27 18.19 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.2 m -98.24 154.25 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.019 0.438 . . . . 0.0 111.711 -172.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.564 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 23.2 m-90 -121.34 115.45 22.97 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.132 175.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.538 ' HB3' HG22 ' A' ' 94' ' ' ILE . 5.5 p90 -118.01 166.83 12.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.556 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -126.97 -25.61 3.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.357 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.8 m -117.86 111.61 19.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.937 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.7 mtm180 -108.45 140.1 42.25 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.035 172.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.6 tttt -121.59 110.23 15.74 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -79.25 87.6 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.985 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.4 p -102.15 -26.78 13.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.207 177.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.5 m120 57.98 90.96 0.08 OUTLIER Pre-proline 0 N--CA 1.469 0.48 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.348 -177.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.425 ' HB3' HG23 ' A' ' 57' ' ' ILE . 46.3 Cg_endo -67.82 136.04 32.19 Favored 'Cis proline' 0 C--N 1.347 0.458 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.81 1.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -77.75 153.31 29.69 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.61 2.207 . . . . 0.0 113.039 -176.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 22.7 t -116.01 153.64 31.29 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.336 176.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -148.08 132.82 17.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.743 0.306 . . . . 0.0 110.758 -179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.9 m -90.71 116.22 28.41 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.936 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.538 HG22 ' HB3' ' A' ' 81' ' ' PHE . 46.8 pt -101.66 148.59 7.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.946 0.403 . . . . 0.0 110.725 -178.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.505 ' HB2' ' HE1' ' A' ' 13' ' ' MET . 97.0 mt-30 -111.44 -28.2 8.29 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.36 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -136.94 152.83 50.64 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.725 -179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -154.56 144.95 22.1 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -114.55 118.26 33.24 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.047 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.57 ' HA ' HG22 ' A' ' 77' ' ' ILE . 3.0 tt -77.62 111.11 13.04 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 76.4 mt -77.78 111.76 13.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.426 -175.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 106' ' ' HIS . 41.1 tp -82.58 83.29 7.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.253 0.549 . . . . 0.0 110.141 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.484 ' HG2' ' HD2' ' A' ' 76' ' ' LYS . 0.0 OUTLIER -87.55 -19.87 27.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.163 178.341 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -74.44 88.48 2.1 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -55.79 -44.42 77.74 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -163.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 23.7 t-80 -80.18 60.74 3.77 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.034 -0.666 . . . . 0.0 111.548 -171.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . 0.531 ' HB2' HD21 ' A' ' 101' ' ' LEU . 63.8 m80 -137.27 9.27 2.95 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.205 172.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 80.2 t60 -118.36 -76.65 0.57 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.378 177.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 68.8 t60 . . . . . 0 C--O 1.245 0.824 0 CA-C-O 118.407 -0.806 . . . . 0.0 109.492 176.654 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.7 mtt . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -136.29 20.04 3.17 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -171.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 69.1 mttm -75.43 -29.32 59.69 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.698 -0.401 . . . . 0.0 110.335 176.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 65.5 t30 64.35 33.86 11.03 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.605 0.717 . . . . 0.0 110.378 176.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -65.69 -24.35 66.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.853 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -78.07 14.81 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.441 -176.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -78.34 -14.87 59.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.232 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -62.37 -23.61 64.72 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.971 -0.558 . . . . 0.0 113.231 -177.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -65.25 -47.99 74.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.108 0.48 . . . . 0.0 110.886 177.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -82.7 -45.81 13.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.256 -178.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.2 m -90.98 95.52 10.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.688 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -71.56 106.66 4.09 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.44 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 72.0 mtm -86.23 158.87 19.62 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.109 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -83.78 125.45 31.94 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.981 0.42 . . . . 0.0 110.474 -177.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 16.0 m -85.24 124.72 32.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.539 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.488 HD11 ' HA ' ' A' ' 32' ' ' THR . 2.9 tm? -121.98 112.85 18.79 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.1 t -93.36 115.23 31.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 -172.07 18.12 Favored Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.752 -175.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -120.35 136.06 54.82 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.923 0.392 . . . . 0.0 110.918 -177.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.438 HG21 HD21 ' A' ' 71' ' ' LEU . 13.0 t -85.59 93.82 3.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.497 178.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 19.6 m -82.64 -34.98 12.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.842 -178.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.695 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.7 mt -133.52 127.58 33.5 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.107 0.479 . . . . 0.0 110.613 178.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -111.92 126.27 54.93 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.271 177.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 27' ' ' ARG . 37.0 t70 -128.21 166.4 18.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.458 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 81.1 m-20 -67.77 106.56 2.29 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.835 0.35 . . . . 0.0 110.141 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.529 ' HA ' ' HB2' ' A' ' 62' ' ' LEU . 47.7 mt-10 78.82 5.81 2.34 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.645 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.797 ' HB2' ' HB3' ' A' ' 24' ' ' ASP . 9.3 mpt_? -127.83 119.61 26.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.914 0.388 . . . . 0.0 110.955 178.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.536 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -110.27 107.98 17.93 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 173.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.695 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 62.8 mt -85.73 104.35 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.49 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.435 ' CD2' HG22 ' A' ' 20' ' ' VAL . 36.5 mt -111.54 151.74 28.34 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.529 -171.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.472 HG22 ' H ' ' A' ' 33' ' ' ASP . 58.6 mt -97.45 123.71 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 168.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.488 ' HA ' HD11 ' A' ' 16' ' ' LEU . 12.2 p -78.6 -10.59 59.79 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.018 0.437 . . . . 0.0 111.396 -177.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.494 ' OD1' ' HG3' ' A' ' 35' ' ' LYS . 6.1 t70 -89.64 162.05 15.81 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 176.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 39.9 p -100.96 9.59 42.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -173.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.494 ' HG3' ' OD1' ' A' ' 33' ' ' ASP . 68.0 mttm -77.25 131.7 38.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.238 175.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.5 122.79 73.39 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.504 178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.11 165.89 30.94 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.797 2.332 . . . . 0.0 112.168 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -101.72 -172.59 27.96 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.776 -176.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 54.7 tptt -62.77 -41.27 99.17 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.027 0.441 . . . . 0.0 110.488 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 34.4 tt0 -64.71 -37.12 86.52 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.39 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.457 ' O ' HD21 ' A' ' 49' ' ' LEU . 15.0 m-20 -60.53 -45.03 95.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.564 178.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -70.88 -14.35 62.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.527 -179.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -93.91 -15.44 24.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.752 0.31 . . . . 0.0 110.749 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.3 mt -72.53 154.19 40.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.2 176.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.1 p -84.98 170.14 13.31 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -176.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -50.24 -48.75 54.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.236 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.3 -43.18 99.45 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.616 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -70.92 -35.96 72.46 Favored 'General case' 0 C--N 1.327 -0.39 0 O-C-N 122.77 -0.253 . . . . 0.0 111.348 -178.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.457 HD21 ' O ' ' A' ' 41' ' ' ASP . 67.3 mt -68.91 -36.92 78.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.89 0.376 . . . . 0.0 110.471 176.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.494 ' HA ' HG21 ' A' ' 57' ' ' ILE . 42.6 ttm -61.78 -34.58 76.15 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.504 176.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -82.71 -44.35 15.76 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.319 -178.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 61.0 tttm -69.09 -34.32 74.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.952 -177.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -114.41 43.1 1.96 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.121 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -50.63 119.53 3.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.727 -0.669 . . . . 0.0 112.107 -176.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 69.15 0.19 2.73 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.081 -0.963 . . . . 0.0 112.75 176.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -96.15 -20.42 18.62 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 170.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.494 HG21 ' HA ' ' A' ' 50' ' ' MET . 8.4 tt -90.24 123.32 42.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.358 179.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -125.51 125.53 68.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.251 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.656 HG12 HG12 ' A' ' 29' ' ' ILE . 58.0 mt -94.57 108.86 21.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 178.436 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.542 HG12 ' HB3' ' A' ' 92' ' ' ALA . 24.8 m -98.25 143.63 12.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 121.088 0.471 . . . . 0.0 110.88 -179.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.44 134.0 12.7 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.102 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.546 HD22 HG21 ' A' ' 68' ' ' THR . 69.4 mt -105.42 16.33 25.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.827 0.346 . . . . 0.0 110.245 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 36.2 m -60.54 -33.07 72.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.071 -0.513 . . . . 0.0 112.303 -174.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.41 -33.87 61.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.684 0.278 . . . . 0.0 111.347 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 15.7 mt -108.33 97.73 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.304 -177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.51 6.78 22.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.28 0.562 . . . . 0.0 110.88 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 86.8 m-20 -99.12 14.51 29.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.21 177.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.546 HG21 HD22 ' A' ' 62' ' ' LEU . 6.9 p -86.4 7.64 24.89 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -80.62 -12.46 59.5 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.281 -179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.77 -19.99 61.93 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.887 -0.597 . . . . 0.0 109.981 174.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.438 HD21 HG21 ' A' ' 20' ' ' VAL . 25.3 tp -67.54 147.35 52.91 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.61 178.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -119.47 172.4 7.67 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.185 0.516 . . . . 0.0 111.73 -178.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -84.9 126.25 33.33 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.489 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 92.11 26.31 19.3 Favored Glycine 0 N--CA 1.444 -0.77 0 N-CA-C 111.279 -0.728 . . . . 0.0 111.279 -175.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -95.64 160.04 14.69 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.915 0.388 . . . . 0.0 111.142 -173.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.544 ' HG2' HD12 ' A' ' 100' ' ' LEU . 46.4 tttp -117.92 111.31 18.82 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -177.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.49 HG22 HD12 ' A' ' 99' ' ' LEU . 44.5 pt -132.4 171.84 17.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 121.745 0.783 . . . . 0.0 112.943 -173.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.2 tttt -133.45 111.65 10.9 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.296 -1.32 . . . . 0.0 108.882 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.493 ' HB ' HG21 ' A' ' 94' ' ' ILE . 34.9 m -106.62 157.43 6.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -173.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -117.39 123.06 45.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.098 172.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -126.22 157.71 37.53 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.813 0.34 . . . . 0.0 110.554 174.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 53.6 m-70 -87.4 -36.88 17.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.093 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.8 t -150.11 168.61 23.42 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.238 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 15.0 ttm180 -123.77 132.0 53.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -110.21 95.24 5.46 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -82.81 84.6 7.31 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.198 0.523 . . . . 0.0 110.996 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 21.5 m -84.78 -12.47 53.61 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.115 175.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.7 m120 60.31 89.99 0.1 OUTLIER Pre-proline 0 N--CA 1.466 0.343 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.546 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.482 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 58.3 Cg_endo -70.13 151.24 92.23 Favored 'Cis proline' 0 C--N 1.349 0.578 0 C-N-CA 123.877 -1.301 . . . . 0.0 113.132 2.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 11.0 Cg_exo -71.14 153.11 62.58 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 123.096 2.53 . . . . 0.0 113.107 -177.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 19.0 t -135.4 160.91 36.96 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.654 177.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.542 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -158.14 170.66 21.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 23.9 m -131.74 130.9 42.51 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.493 HG21 ' HB ' ' A' ' 79' ' ' VAL . 44.5 pt -109.09 145.05 16.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.966 0.412 . . . . 0.0 111.158 -176.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -109.13 -16.24 14.14 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.833 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -161.71 147.72 13.78 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.0 p90 -152.19 164.9 36.39 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.338 -0.245 . . . . 0.0 110.338 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -114.8 136.45 53.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.867 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.49 HD12 HG22 ' A' ' 77' ' ' ILE . 29.8 tp -92.26 118.88 31.32 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.544 HD12 ' HG2' ' A' ' 76' ' ' LYS . 93.7 mt -83.43 119.03 24.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.196 0.522 . . . . 0.0 110.582 -176.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.4 mt -75.52 -1.6 25.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.529 -176.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -68.2 -14.15 62.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.198 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 56.2 t60 -56.04 -51.95 65.99 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.441 178.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 63.8 t60 -119.19 81.63 1.74 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.167 0.508 . . . . 0.0 109.642 -177.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.85 121.53 17.48 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.974 -177.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -85.4 120.33 26.75 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.8 t-80 -113.56 135.37 53.98 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 56.9 m-70 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.737 -0.649 . . . . 0.0 109.891 -178.073 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.9 mtp . . . . . 0 N--CA 1.482 1.158 0 CA-C-O 120.533 0.206 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 -99.04 129.14 45.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.778 0.323 . . . . 0.0 111.525 -177.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -79.39 -33.01 43.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 169.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -110.52 105.99 15.12 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.751 173.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -63.22 -57.06 11.72 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.454 -174.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.51 89.38 6.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.1 0.476 . . . . 0.0 110.305 -179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 17.9 p-10 -85.05 98.42 10.4 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.545 0.688 . . . . 0.0 110.332 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -141.19 135.33 6.82 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.113 -179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -69.25 95.39 0.77 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.453 0.645 . . . . 0.0 110.146 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -163.01 -50.61 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.208 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.1 p -93.96 90.0 6.29 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.029 169.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -76.61 143.55 40.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.344 0.593 . . . . 0.0 111.446 -173.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.408 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 67.4 mtm -90.94 123.77 34.7 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.749 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -83.39 116.55 22.54 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.511 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 12.3 t -103.9 144.57 31.33 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.199 0.523 . . . . 0.0 111.694 -171.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.0 OUTLIER -135.52 136.99 41.65 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.307 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.493 ' N ' HD13 ' A' ' 16' ' ' LEU . 58.7 t -106.19 124.11 61.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 120.7 0.286 . . . . 0.0 110.393 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.25 167.72 29.0 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.11 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -104.94 128.01 53.02 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 -176.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.502 HG21 HD11 ' A' ' 71' ' ' LEU . 21.9 t -75.69 99.2 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 175.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.454 HG12 ' CE2' ' A' ' 42' ' ' TYR . 34.6 m -98.27 -38.73 7.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.671 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.731 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 94.4 mt -131.46 131.5 43.56 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.667 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -116.07 119.77 36.93 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.548 -178.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -88.42 -73.69 0.49 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.396 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 171.73 -64.13 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 -177.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.66 -25.72 21.1 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.141 175.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.9 OUTLIER -116.55 151.89 35.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.694 -179.859 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.546 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.35 127.84 41.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.65 173.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.731 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 68.0 mt -89.68 107.93 18.72 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 34.2 mt -111.24 137.72 48.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.486 -177.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.448 HD11 HD13 ' A' ' 49' ' ' LEU . 9.7 mt -105.27 148.76 9.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.484 HG21 HD11 ' A' ' 16' ' ' LEU . 19.1 p -128.76 155.18 45.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 121.232 -0.187 . . . . 0.0 111.268 -176.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 54.28 41.26 32.08 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.631 0.582 . . . . 0.0 111.122 176.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -108.77 -4.59 16.81 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.011 -175.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.37 36.06 23.26 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.956 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' A' ' 37' ' ' PRO . . . 64.34 107.45 0.03 OUTLIER Pre-proline 0 N--CA 1.464 0.253 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.87 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 36' ' ' ALA . 26.4 Cg_endo -63.14 163.67 22.14 Favored 'Trans proline' 0 C--O 1.237 0.443 0 C-N-CA 122.802 2.334 . . . . 0.0 112.293 -178.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.459 ' O ' ' HD1' ' A' ' 42' ' ' TYR . . . -89.82 172.22 38.54 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.887 -178.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -64.18 -25.54 68.12 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.659 0.266 . . . . 0.0 111.128 -176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -76.88 -29.96 56.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.071 0.462 . . . . 0.0 110.175 177.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -69.95 -35.7 74.7 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.459 ' HD1' ' O ' ' A' ' 38' ' ' GLY . 69.3 m-85 -71.12 -16.21 62.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.458 174.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -83.41 -28.94 28.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.045 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 73.0 mt -67.9 142.55 56.03 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.306 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 m -91.32 -174.14 3.84 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.474 -177.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -52.55 -56.22 16.75 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.026 -173.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -63.01 -35.91 92.74 Favored Glycine 0 N--CA 1.454 -0.144 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.388 -177.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -68.63 -39.33 80.82 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.578 0.228 . . . . 0.0 111.148 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD13 HD11 ' A' ' 31' ' ' ILE . 90.7 mt -78.26 -35.67 47.81 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.964 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 42.9 ttm -58.83 -42.73 89.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.194 -179.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -93.24 2.76 56.49 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.463 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -100.56 -40.48 7.4 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.196 0.522 . . . . 0.0 109.76 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . 0.551 ' HB3' ' HB2' ' A' ' 56' ' ' ASN . 81.0 m-85 -118.58 55.58 0.91 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.59 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 56.0 tttp -51.5 -35.95 42.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.5 -173.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -100.42 -8.77 22.88 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.593 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.551 ' HB2' ' HB3' ' A' ' 53' ' ' PHE . 2.9 m-20 -114.02 2.03 14.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -171.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 12.6 tt -98.48 123.74 51.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.113 0.482 . . . . 0.0 110.861 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 72.8 t -125.02 126.02 70.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.967 177.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 91' ' ' SER . 61.6 mt -97.84 105.18 16.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.307 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.9 m -90.68 150.44 3.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.277 -176.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.66 119.59 6.53 Favored Glycine 0 N--CA 1.443 -0.842 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.883 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.546 HD11 ' HB2' ' A' ' 28' ' ' ALA . 35.4 mt -92.33 7.99 40.35 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.275 0.559 . . . . 0.0 110.09 -178.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.0 t -65.46 -23.69 66.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.296 -170.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -97.72 5.52 49.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.088 0.47 . . . . 0.0 111.214 -175.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 52.3 mt -95.75 154.96 3.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.253 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.31 -68.93 0.13 Allowed 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.363 0.414 . . . . 0.0 110.928 179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -163.41 131.04 3.55 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 176.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.507 HG21 HD13 ' A' ' 62' ' ' LEU . 37.0 p -97.29 35.3 1.63 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.039 -174.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -68.28 -22.56 64.73 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.091 -177.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -92.95 5.93 49.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.112 -176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.502 HD11 HG21 ' A' ' 20' ' ' VAL . 24.1 tp -99.02 121.19 40.64 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.365 -178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -114.1 -172.57 2.12 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.954 0.407 . . . . 0.0 110.544 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -85.47 146.1 27.11 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.479 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.429 ' HA2' ' CE2' ' A' ' 42' ' ' TYR . . . 76.46 39.93 29.19 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 116.029 -0.532 . . . . 0.0 112.636 174.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -127.02 158.62 36.45 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.65 -0.42 . . . . 0.0 110.619 -177.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.416 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 38.5 mttp -102.62 136.45 42.43 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.4 pt -133.1 140.44 47.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.336 0.589 . . . . 0.0 111.25 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 88.0 tttt -100.29 106.82 18.5 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 173.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.511 ' O ' ' HA ' ' A' ' 15' ' ' SER . 29.2 m -100.16 154.11 4.45 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.582 -172.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.507 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 18.6 m-90 -120.61 117.65 28.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.414 174.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.615 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.9 OUTLIER -133.88 167.15 21.11 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.825 -175.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -152.37 -37.7 0.11 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.739 176.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 7.1 m -80.23 108.02 13.49 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.451 176.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.8 mtp180 -102.52 153.51 20.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.148 0.499 . . . . 0.0 111.532 179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.645 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 98.0 mttt -133.6 114.01 13.05 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.747 174.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -80.9 58.31 3.35 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.852 0.834 . . . . 0.0 109.697 178.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.6 t -76.37 -16.4 59.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.171 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 p30 42.92 100.08 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 112.382 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -65.15 150.07 75.3 Favored 'Cis proline' 0 C--N 1.345 0.381 0 C-N-CA 123.804 -1.332 . . . . 0.0 113.053 3.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.47 136.54 74.96 Favored 'Trans proline' 0 C--O 1.233 0.258 0 C-N-CA 123.014 2.476 . . . . 0.0 112.524 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.645 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 19.7 m -115.72 149.03 39.09 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.567 177.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.411 ' HB1' ' CD2' ' A' ' 81' ' ' PHE . . . -143.53 121.63 12.16 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.794 0.33 . . . . 0.0 111.258 -177.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 29.3 m -82.07 113.67 20.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.615 HG22 ' HB3' ' A' ' 81' ' ' PHE . 35.2 pt -96.18 142.58 13.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.033 0.444 . . . . 0.0 110.697 -177.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 88.9 mt-30 -90.59 -19.28 23.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.092 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -171.01 150.26 3.06 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.655 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.77 157.94 31.28 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.507 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 23.2 tt0 -115.54 112.34 22.06 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 172.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.5 tp -71.58 107.18 4.33 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.739 -174.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.416 ' HB2' ' HB2' ' A' ' 76' ' ' LYS . 78.5 mt -81.83 90.8 6.43 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.477 179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 95.6 mt -61.05 140.89 57.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.484 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.491 ' HB3' ' O ' ' A' ' 108' ' ' HIS . 21.4 mm-40 -67.35 -175.8 0.52 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.614 0.721 . . . . 0.0 112.431 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 58.8 m80 -99.71 -0.93 39.08 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.802 -167.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.43 ' HB2' ' H ' ' A' ' 108' ' ' HIS . 72.6 m80 -137.69 152.22 49.05 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.749 177.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 30.5 m-70 -84.11 -34.92 24.02 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.27 -176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 73.6 m-70 -130.24 42.12 3.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.861 0.363 . . . . 0.0 111.731 -176.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.44 ' HB3' ' H ' ' A' ' 108' ' ' HIS . 5.6 t-80 -160.71 -87.36 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.054 176.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . 0.491 ' O ' ' HB3' ' A' ' 102' ' ' GLU . 54.0 t60 . . . . . 0 C--O 1.238 0.45 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.452 ' HB3' ' H ' ' A' ' 2' ' ' ASN . 56.7 mtt . . . . . 0 N--CA 1.479 1.008 0 CA-C-O 120.814 0.34 . . . . 0.0 110.967 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.452 ' H ' ' HB3' ' A' ' 1' ' ' MET . 1.7 m-20 -54.48 -47.59 72.81 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -169.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.6 tttt -74.12 -9.49 58.68 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.773 -173.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -67.96 -10.98 57.77 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.061 0.458 . . . . 0.0 111.099 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -80.66 -30.02 36.61 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.161 176.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -129.71 103.47 6.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.595 -175.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -59.97 -39.65 86.4 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.85 -110.34 3.12 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.2 -0.909 . . . . 0.0 113.919 170.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -64.88 -19.39 65.88 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -171.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -90.03 -0.85 57.81 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.303 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 17.1 p -132.29 122.15 24.7 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.888 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 34.7 mtmt -87.35 119.3 27.47 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.118 0.485 . . . . 0.0 111.108 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.574 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 95.8 mmm -98.24 130.68 44.95 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.267 175.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 83.9 mm-40 -83.38 118.62 23.83 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.648 0.261 . . . . 0.0 111.195 -176.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 m -81.15 111.9 18.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 -179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.544 HD11 HG22 ' A' ' 32' ' ' THR . 2.0 tm? -130.92 124.89 32.07 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.3 p -92.75 132.3 37.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-O 120.786 0.327 . . . . 0.0 110.327 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.59 162.78 28.93 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.755 -177.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -105.84 126.03 51.7 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.576 0.227 . . . . 0.0 110.648 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 29.0 t -73.44 107.62 4.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.467 HG13 ' HG ' ' A' ' 22' ' ' LEU . 12.2 p -120.23 -32.12 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 O-C-N 123.271 0.357 . . . . 0.0 111.062 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.992 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.9 mt -127.73 145.07 51.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.818 0.342 . . . . 0.0 110.999 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -119.1 135.8 54.47 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.35 178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.554 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 0.9 OUTLIER -92.77 -66.77 0.9 Allowed 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.141 171.128 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 6.1 t30 160.9 -51.45 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 107.672 -1.233 . . . . 0.0 107.672 177.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -101.18 -24.76 14.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.406 -1.27 . . . . 0.0 108.69 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.463 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 24.3 mtm180 -117.92 158.95 23.96 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.607 -1.178 . . . . 0.0 110.464 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.573 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -124.61 139.87 53.47 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 175.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.992 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 32.5 mt -102.41 109.29 26.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 mt -113.16 144.39 42.75 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.047 -172.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.76 119.74 35.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.883 173.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 HD11 ' A' ' 16' ' ' LEU . 75.9 p -81.78 -23.66 36.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.959 0.409 . . . . 0.0 110.665 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.401 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 38.7 t70 -78.48 95.08 5.05 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 174.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.4 t -63.88 90.69 0.06 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 122.155 0.978 . . . . 0.0 112.127 -173.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -138.35 135.56 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.656 -1.157 . . . . 0.0 108.356 172.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.35 113.24 15.41 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.498 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.0 158.02 50.27 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.842 2.361 . . . . 0.0 111.62 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -82.37 168.99 48.92 Favored Glycine 0 N--CA 1.444 -0.833 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.938 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -64.1 -28.12 69.56 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.948 0.404 . . . . 0.0 110.593 -178.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -81.38 -26.56 35.37 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.911 177.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.67 -34.73 78.99 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -69.33 -16.19 63.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.665 175.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -94.53 -18.06 21.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.772 -179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 93.9 mt -63.92 152.87 38.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.117 0.484 . . . . 0.0 110.953 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.3 p -77.51 166.62 22.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.322 -178.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.416 ' HA ' ' CD1' ' A' ' 22' ' ' LEU . 37.2 tt0 -52.77 -52.69 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.936 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -61.68 -42.13 99.71 Favored Glycine 0 N--CA 1.449 -0.48 0 CA-C-N 115.729 -0.668 . . . . 0.0 112.686 -177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -68.04 -37.38 81.26 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.754 0.277 . . . . 0.0 111.654 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.525 HD12 HD21 ' A' ' 22' ' ' LEU . 72.8 mt -70.42 -34.17 72.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.796 0.331 . . . . 0.0 110.501 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.415 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 62.7 mtt -73.22 -15.7 61.43 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.094 176.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -91.04 -40.16 11.79 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.861 0.363 . . . . 0.0 110.35 175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.31 -47.71 69.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.449 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -108.65 46.86 0.94 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.81 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 50' ' ' MET . 57.0 tttp -56.27 131.14 47.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.374 -176.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 69.19 -5.52 1.07 Allowed 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.276 -0.874 . . . . 0.0 112.206 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.401 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 29.0 m-80 -106.14 9.75 32.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.579 0.704 . . . . 0.0 109.495 176.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.4 HD11 HG22 ' A' ' 29' ' ' ILE . 20.2 tt -120.48 128.62 76.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.603 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HG2' ' A' ' 90' ' ' PRO . 53.7 t -121.98 137.84 54.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 120.893 0.378 . . . . 0.0 110.969 -174.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 91' ' ' SER . 56.5 mt -95.93 111.13 25.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.97 139.03 18.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-O 121.155 0.502 . . . . 0.0 111.231 -177.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -87.57 113.09 3.93 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.573 HD11 ' HB2' ' A' ' 28' ' ' ALA . 59.5 mt -87.55 43.13 1.09 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.026 0.441 . . . . 0.0 110.39 -176.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.4 t -59.52 -45.51 91.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.654 -176.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.686 ' HB2' ' HA ' ' A' ' 95' ' ' GLN . 1.1 mp0 -87.86 11.09 16.51 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.05 0.453 . . . . 0.0 111.27 -176.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 62' ' ' LEU . 51.4 mm -106.45 134.38 48.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 175.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.44 -64.27 1.21 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.163 -175.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -123.69 140.64 52.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 47.7 p -111.45 27.58 9.54 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.163 0.506 . . . . 0.0 111.551 -169.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -73.01 -25.13 60.86 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.566 -0.743 . . . . 0.0 112.189 -172.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -74.59 -27.22 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.692 0.282 . . . . 0.0 111.118 -178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mp -68.06 125.13 25.37 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -114.74 150.98 34.49 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 48.2 mtm105 -68.83 112.46 5.54 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 171.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.0 33.38 4.67 Favored Glycine 0 N--CA 1.443 -0.897 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 -174.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -118.53 151.38 37.96 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.498 ' HG2' HD12 ' A' ' 100' ' ' LEU . 81.1 tttt -111.8 122.99 49.3 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.827 0.346 . . . . 0.0 110.755 -176.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.489 HG22 HD12 ' A' ' 99' ' ' LEU . 38.2 pt -132.14 149.6 32.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.296 0.57 . . . . 0.0 111.347 -179.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -105.96 108.13 19.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 174.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 97' ' ' TYR . 28.2 m -98.66 153.02 4.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 121.255 0.55 . . . . 0.0 111.632 -173.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.574 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 8.5 m-90 -121.2 113.46 20.01 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.802 174.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 94' ' ' ILE . 30.4 p90 -107.24 146.93 30.84 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.619 179.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -99.22 -25.17 14.6 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.326 -176.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.6 t -160.29 152.59 20.63 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 178.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 92' ' ' ALA . 32.9 mtm180 -110.25 169.75 8.53 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.344 0.592 . . . . 0.0 111.064 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 91' ' ' SER . 57.5 tttp -140.74 91.39 2.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.015 -0.993 . . . . 0.0 108.47 173.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.519 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 35.2 tt0 -83.96 109.81 17.92 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.363 -173.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.3 t -121.08 -0.27 10.03 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.417 174.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 59.37 102.08 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.47 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.212 -175.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.42 146.07 72.14 Favored 'Cis proline' 0 C--N 1.344 0.301 0 C-N-CA 123.563 -1.432 . . . . 0.0 112.24 0.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.532 ' HG2' HG22 ' A' ' 58' ' ' VAL . 20.6 Cg_endo -62.82 138.78 70.82 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.489 2.126 . . . . 0.0 112.202 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.474 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 28.2 t -104.0 156.09 18.14 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 84' ' ' ARG . . . -147.56 108.58 4.23 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.685 0.278 . . . . 0.0 110.911 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.4 m -73.02 110.08 7.03 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.859 0.361 . . . . 0.0 110.601 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.643 ' HA ' ' HA ' ' A' ' 81' ' ' PHE . 45.4 pt -98.95 147.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.356 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.686 ' HA ' ' HB2' ' A' ' 64' ' ' GLU . 96.7 mt-30 -109.61 -8.98 14.9 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.581 -179.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -165.98 148.74 7.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.172 179.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.512 ' HB3' HG12 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -137.35 167.37 21.75 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 172.475 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -129.32 131.06 46.84 Favored 'General case' 0 C--N 1.316 -0.874 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.489 HD12 HG22 ' A' ' 77' ' ' ILE . 17.4 tp -79.17 111.87 15.83 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -178.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.498 HD12 ' HG2' ' A' ' 76' ' ' LYS . 86.0 mt -82.5 130.4 35.1 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.983 -178.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 79.4 mt -95.26 130.84 41.86 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.6 -176.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -67.52 107.9 2.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 176.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 33.4 m170 -83.43 69.43 10.03 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.337 0.589 . . . . 0.0 109.792 179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -72.17 151.93 42.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.885 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -72.96 -24.98 60.85 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.257 -175.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 82.6 t60 69.46 16.33 8.22 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.808 0.814 . . . . 0.0 109.504 -173.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -86.28 -17.68 33.99 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 177.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 43.1 m80 . . . . . 0 C--O 1.247 0.968 0 CA-C-N 114.724 -1.126 . . . . 0.0 109.155 174.801 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.9 mtt . . . . . 0 N--CA 1.483 1.205 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -74.42 -29.67 61.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 171.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 mtmm -105.73 99.21 8.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.633 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -105.76 172.94 6.53 Favored 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.196 176.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -79.86 68.79 6.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.436 0.636 . . . . 0.0 111.547 -172.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -171.34 -66.25 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.581 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -91.38 41.89 1.08 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.281 0.562 . . . . 0.0 110.737 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -169.02 31.51 0.17 Allowed Glycine 0 N--CA 1.445 -0.722 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.494 178.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.478 ' CG ' ' H ' ' A' ' 10' ' ' GLU . 11.2 t70 -112.89 -164.03 0.89 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' H ' ' CG ' ' A' ' 9' ' ' ASP . 35.2 mt-10 -124.85 -20.41 5.01 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.744 0.307 . . . . 0.0 111.113 -175.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.1 t -83.69 148.62 26.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.161 0.505 . . . . 0.0 110.763 -177.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -111.38 90.89 3.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.687 179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.434 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 72.8 mtp -119.99 140.61 50.68 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.333 -177.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.4 mt-30 -88.67 135.3 33.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.848 -179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.594 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 35.8 p -101.67 139.43 37.32 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.063 0.459 . . . . 0.0 111.634 -174.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.3 tp -140.34 120.82 14.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.542 177.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.434 HG22 ' HB2' ' A' ' 78' ' ' LYS . 55.9 t -90.23 127.01 43.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.293 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.64 158.6 27.73 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 121.012 -0.613 . . . . 0.0 112.148 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.791 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 80.0 m-85 -99.37 129.77 45.6 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.8 t -83.07 108.4 15.75 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.227 -177.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.2 m -103.34 -28.48 3.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 123.318 0.386 . . . . 0.0 111.033 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.923 HD23 HD12 ' A' ' 29' ' ' ILE . 39.2 tp -136.21 122.82 20.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.869 0.366 . . . . 0.0 110.55 177.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -105.96 123.57 48.2 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.659 -178.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -113.04 167.57 10.42 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -70.84 -31.96 68.83 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.63 0.252 . . . . 0.0 111.517 -176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -122.76 1.86 9.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.593 0.235 . . . . 0.0 111.324 179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -142.83 167.78 21.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.82 0.343 . . . . 0.0 110.665 -174.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.496 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.72 119.66 9.35 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 116.161 -0.472 . . . . 0.0 109.8 173.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.923 HD12 HD23 ' A' ' 22' ' ' LEU . 33.3 mt -85.73 107.86 16.75 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-O 121.217 0.532 . . . . 0.0 110.014 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.458 HD22 HG22 ' A' ' 20' ' ' VAL . 20.2 mt -110.44 141.94 42.85 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.163 -176.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.4 mt -101.92 122.13 53.76 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 172.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.9 p -71.47 91.77 1.06 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.315 0.579 . . . . 0.0 111.083 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.791 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 45.9 t0 65.22 93.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.465 -1.243 . . . . 0.0 111.848 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.44 10.66 40.23 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.233 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 87.5 mttt 56.13 35.66 26.06 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 -172.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.43 102.98 0.03 OUTLIER Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.61 -171.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -59.4 157.21 32.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.869 2.38 . . . . 0.0 112.391 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -86.11 166.85 39.11 Favored Glycine 0 N--CA 1.443 -0.839 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.641 178.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -57.67 -37.38 73.29 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.744 0.307 . . . . 0.0 111.06 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 19.2 mm-40 -73.84 -24.01 59.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.64 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -70.6 -33.87 71.53 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.52 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 80.5 m-85 -74.82 -17.92 60.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.363 174.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -90.12 -12.62 37.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.062 179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 85.5 mt -67.42 166.14 15.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.129 0.49 . . . . 0.0 111.079 176.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 69.1 p -97.65 171.78 8.12 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -53.82 -55.8 23.35 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.303 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -57.9 -41.19 94.07 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.264 -0.493 . . . . 0.0 112.842 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.9 mt-30 -63.42 -44.38 94.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.738 0.304 . . . . 0.0 110.692 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 97.1 mt -63.68 -42.74 98.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.954 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.405 ' HG2' HD13 ' A' ' 57' ' ' ILE . 88.9 mtp -60.22 -33.88 72.88 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.652 -179.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -92.22 -34.89 14.1 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -71.33 -47.78 54.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.9 0.381 . . . . 0.0 110.425 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -106.04 44.08 1.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.633 0.73 . . . . 0.0 109.86 -179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 55' ' ' ASN . 81.3 tttt -54.62 140.6 34.67 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.246 -177.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 92.7 m-20 76.37 -40.96 0.4 Allowed 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.62 0.768 . . . . 0.0 112.329 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -80.83 -1.04 41.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.969 0.414 . . . . 0.0 110.806 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.517 HG23 ' HB3' ' A' ' 89' ' ' PRO . 7.4 tt -90.8 118.77 36.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.308 0.575 . . . . 0.0 110.43 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -117.92 125.19 74.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.108 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.679 HG12 HG12 ' A' ' 29' ' ' ILE . 55.1 mt -99.49 100.35 10.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 179.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.441 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 35.5 m -83.66 154.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 121.015 0.436 . . . . 0.0 110.7 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.412 ' CA ' ' HA ' ' A' ' 93' ' ' THR . . . -96.41 125.95 8.63 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 121.067 -0.587 . . . . 0.0 111.934 -179.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.57 ' HB3' HG21 ' A' ' 68' ' ' THR . 86.6 mt -109.31 9.74 25.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.805 0.336 . . . . 0.0 110.693 -178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 8.4 t -64.78 -21.99 66.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.451 -175.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -91.88 0.66 57.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.709 0.29 . . . . 0.0 111.156 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 47.1 mt -124.34 117.8 51.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.868 0.365 . . . . 0.0 110.081 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -72.76 -55.88 6.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.047 0.451 . . . . 0.0 111.658 -176.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -85.35 66.85 9.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.208 0.528 . . . . 0.0 111.736 -173.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.57 HG21 ' HB3' ' A' ' 62' ' ' LEU . 69.1 p -99.54 8.9 44.09 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.229 172.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.79 -18.92 65.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 110.731 -176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -77.51 -12.43 59.96 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.302 177.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 15.5 tp -87.92 126.25 34.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.792 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.407 ' HD2' ' OE2' ' A' ' 75' ' ' GLU . 35.8 mttt -112.76 -179.82 3.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.133 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 31.0 mtm105 -88.57 59.56 5.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.85 0.357 . . . . 0.0 110.417 174.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.52 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 176.54 42.61 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.236 -0.745 . . . . 0.0 111.236 179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.519 ' HG3' HD12 ' A' ' 71' ' ' LEU . 40.5 mm-40 -111.87 173.18 6.48 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.288 0.566 . . . . 0.0 111.441 -173.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -137.48 102.23 4.72 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.641 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 34.1 pt -125.44 154.9 34.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.764 0.793 . . . . 0.0 113.093 -170.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.495 ' HE2' ' CZ2' ' A' ' 80' ' ' TRP . 43.3 tttt -115.77 106.44 13.86 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.301 -1.318 . . . . 0.0 108.551 175.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.594 ' O ' ' HA ' ' A' ' 15' ' ' SER . 22.1 m -96.14 156.86 3.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 -169.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.495 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 5.4 m-90 -122.99 126.44 47.16 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.338 175.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -136.86 160.16 39.71 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.584 176.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -96.45 -23.08 16.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 178.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -157.57 158.51 35.74 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.124 -174.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -122.98 154.16 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.18 0.514 . . . . 0.0 110.805 177.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -103.68 102.51 12.37 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 173.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -77.85 62.24 2.64 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.911 -175.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.7 p -81.66 -30.15 32.83 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.031 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 66.3 101.72 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.42 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.669 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.517 ' HB3' HG23 ' A' ' 57' ' ' ILE . 31.3 Cg_endo -63.11 142.13 42.3 Favored 'Cis proline' 0 C--N 1.347 0.484 0 C-N-CA 123.779 -1.342 . . . . 0.0 112.657 2.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 34.3 Cg_exo -58.91 134.91 63.26 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.79 2.327 . . . . 0.0 112.159 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.408 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.3 p -123.45 144.59 49.41 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.85 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -151.26 110.3 3.9 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.285 -177.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.412 ' HA ' ' CA ' ' A' ' 61' ' ' GLY . 12.8 m -68.29 117.25 9.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.216 176.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG21 ' HB ' ' A' ' 79' ' ' VAL . 42.5 pt -100.6 151.77 5.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 121.154 0.502 . . . . 0.0 110.938 -176.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -112.78 -18.65 12.25 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.338 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -143.1 151.13 40.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.777 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 94' ' ' ILE . 1.2 p90 -155.93 150.01 25.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.965 0.412 . . . . 0.0 110.02 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.44 124.47 52.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.413 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 64.5 tp -83.63 117.67 23.33 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.952 0.406 . . . . 0.0 110.393 -177.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 97.5 mt -111.94 -179.85 3.81 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.084 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.644 ' HG ' ' H ' ' A' ' 102' ' ' GLU . 26.8 tp -157.92 -176.74 6.1 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.408 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.644 ' H ' ' HG ' ' A' ' 101' ' ' LEU . 7.2 mm-40 -78.68 175.92 9.97 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 171.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 79.9 m-70 -86.33 20.86 2.24 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.64 0.733 . . . . 0.0 109.708 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -140.74 169.73 17.09 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.643 -1.162 . . . . 0.0 108.149 175.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.8 m170 -68.06 -32.78 73.35 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.067 -0.253 . . . . 0.0 111.324 179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 43.6 m170 -121.36 -90.71 0.57 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.053 0.454 . . . . 0.0 109.885 176.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -147.99 -51.85 0.18 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 174.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 68.9 t60 . . . . . 0 C--O 1.246 0.89 0 CA-C-N 114.452 -1.249 . . . . 0.0 108.35 171.911 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.5 mtt . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 120.915 0.388 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -144.99 99.02 3.27 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 177.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -77.57 158.34 29.89 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.579 0.704 . . . . 0.0 112.181 -174.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.723 HD21 ' HB3' ' A' ' 6' ' ' GLN . 16.3 t30 -109.48 125.77 52.81 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.872 174.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -69.49 -28.85 66.42 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.979 0.419 . . . . 0.0 110.423 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.723 ' HB3' HD21 ' A' ' 4' ' ' ASN . 42.0 tt0 -59.3 -33.23 70.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.029 173.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 57.8 t30 60.25 92.58 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.578 178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -148.25 -160.24 8.9 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 111.354 -0.699 . . . . 0.0 111.354 179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.1 p-10 -89.38 -14.63 35.13 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.063 0.458 . . . . 0.0 109.856 178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 67.93 31.45 5.64 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.058 -0.974 . . . . 0.0 112.703 176.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -90.14 10.88 22.72 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.752 0.787 . . . . 0.0 109.29 171.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 12' ' ' LYS . 14.6 pttm -75.67 117.6 17.61 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 121.438 0.637 . . . . 0.0 109.986 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.531 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 70.3 mtm -107.89 125.78 51.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.264 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -83.66 121.11 26.82 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.263 -178.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.517 ' HB3' ' HE2' ' A' ' 78' ' ' LYS . 48.8 m -85.42 129.24 34.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.123 -177.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 16' ' ' LEU . 1.1 tm? -137.5 124.56 21.54 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.8 t -90.31 126.67 43.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.195 -0.457 . . . . 0.0 109.99 178.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.44 169.31 29.05 Favored Glycine 0 N--CA 1.445 -0.73 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.359 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.415 ' CD2' ' HG2' ' A' ' 76' ' ' LYS . 94.2 m-85 -107.14 133.96 50.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.657 0.265 . . . . 0.0 110.353 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.412 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 20.0 t -85.39 110.27 19.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.34 -177.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 45.8 t -107.23 -63.19 1.91 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 123.497 0.498 . . . . 0.0 110.704 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 1.018 HD23 HD12 ' A' ' 29' ' ' ILE . 41.6 tp -111.51 110.47 20.91 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.948 0.404 . . . . 0.0 110.702 -176.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HE3' ' HA ' ' A' ' 69' ' ' ASP . 42.6 tttm -100.01 126.58 46.22 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.514 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.452 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 15.7 t70 -106.27 -158.08 0.64 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 174.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.452 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 72.9 m-20 -89.1 -54.72 3.98 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.172 0.511 . . . . 0.0 109.747 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -98.26 -10.72 23.53 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.027 -175.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 32.2 mtt180 -131.87 149.7 52.37 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.733 -172.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -127.13 115.36 19.0 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 172.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 1.018 HD12 HD23 ' A' ' 22' ' ' LEU . 34.7 mt -87.94 107.55 17.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.394 0.616 . . . . 0.0 110.396 -178.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 20' ' ' VAL . 29.3 mt -114.32 158.13 21.86 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.914 -1.039 . . . . 0.0 110.416 -176.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.55 ' CG2' ' HB ' ' A' ' 34' ' ' THR . 36.9 mt -110.37 123.8 66.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 176.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.3 p -78.14 107.85 11.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.375 -177.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 54.05 75.49 0.27 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.634 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.55 ' HB ' ' CG2' ' A' ' 31' ' ' ILE . 10.0 t -108.56 -0.01 20.56 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.637 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.8 mttp 57.11 41.18 27.67 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.837 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . 70.98 112.57 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.36 0 CA-C-N 114.64 -1.164 . . . . 0.0 111.8 179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.536 ' HG3' HG21 ' A' ' 34' ' ' THR . 6.5 Cg_exo -73.03 178.88 5.95 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.833 2.356 . . . . 0.0 111.469 176.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.5 166.23 25.27 Favored Glycine 0 N--CA 1.443 -0.886 0 C-N-CA 120.325 -0.94 . . . . 0.0 112.31 -178.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -62.79 -27.21 69.15 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.6 mt-10 -59.71 -47.6 85.0 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.363 174.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 -67.04 -32.87 74.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.833 -175.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.503 ' CE1' ' HA2' ' A' ' 74' ' ' GLY . 53.6 m-85 -73.45 -16.44 61.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 111.058 177.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -93.44 -22.14 19.08 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.07 0.462 . . . . 0.0 110.143 178.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 89.7 mt -69.52 157.1 37.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.056 -178.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.3 m -88.1 179.07 6.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.363 177.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.439 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -58.9 -43.58 91.06 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.346 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.8 -42.27 93.13 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.087 -0.578 . . . . 0.0 112.478 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.404 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 84.5 mt-30 -64.16 -39.53 94.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.065 0.46 . . . . 0.0 110.429 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.2 tp -68.96 -48.38 63.31 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.34 176.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.439 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 41.3 ttm -55.88 -49.02 74.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.918 -174.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -81.98 -8.43 59.67 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -90.11 -51.5 5.43 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.003 0.43 . . . . 0.0 110.408 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -101.75 33.24 3.06 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.33 -179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 77.6 tttt -56.89 -29.52 63.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -170.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -101.44 3.43 40.36 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.452 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -132.84 18.16 4.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.124 0.487 . . . . 0.0 110.063 -179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.449 HD11 ' CG2' ' A' ' 29' ' ' ILE . 17.5 tt -109.75 134.08 52.99 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.744 -174.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 88.4 t -132.64 122.59 47.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 121.042 0.448 . . . . 0.0 110.448 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.715 HG12 HG12 ' A' ' 29' ' ' ILE . 48.4 mt -92.99 103.62 14.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.46 176.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.477 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.0 m -83.1 145.64 8.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.136 0.493 . . . . 0.0 110.714 -178.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.75 122.41 6.65 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.103 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.529 ' HB3' HG21 ' A' ' 68' ' ' THR . 68.5 mt -98.98 11.62 38.41 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 123.925 0.426 . . . . 0.0 110.188 -179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 m -57.42 -25.16 59.18 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.675 -174.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -98.37 6.47 47.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.158 0.504 . . . . 0.0 111.015 -176.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 36.0 mt -125.25 107.02 17.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 177.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -84.63 21.19 1.56 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.817 0.341 . . . . 0.0 111.792 -174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -157.77 81.58 0.87 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.16 0.505 . . . . 0.0 109.769 176.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.529 HG21 ' HB3' ' A' ' 62' ' ' LEU . 10.2 p -114.21 9.08 17.02 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.908 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.54 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 41.7 m-20 -79.49 2.67 21.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.115 0.483 . . . . 0.0 111.292 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -82.29 -13.7 56.57 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.576 170.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.8 tp -76.2 130.63 38.5 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.468 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.568 ' HB2' ' CG ' ' A' ' 75' ' ' GLU . 4.2 mtpm? -106.02 165.12 11.44 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.393 -177.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 60.7 mtm180 -89.96 123.8 34.19 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 175.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.503 ' HA2' ' CE1' ' A' ' 42' ' ' TYR . . . 98.01 37.5 4.38 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.754 -177.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.568 ' CG ' ' HB2' ' A' ' 72' ' ' LYS . 67.4 mm-40 -116.61 175.75 5.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.181 0.515 . . . . 0.0 111.74 -174.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.415 ' HG2' ' CD2' ' A' ' 19' ' ' TYR . 52.9 mtpt -124.44 123.57 40.44 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.182 177.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 36.5 pt -135.41 153.76 34.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.622 0.725 . . . . 0.0 112.294 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 98' ' ' GLU . 56.0 tttm -110.39 106.52 15.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 114.717 -1.129 . . . . 0.0 108.588 173.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 26.7 m -94.56 154.29 3.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.148 0.499 . . . . 0.0 112.179 -172.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.531 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.7 m0 -118.47 104.13 10.4 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.142 -0.935 . . . . 0.0 110.455 175.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.547 ' HB3' HG22 ' A' ' 94' ' ' ILE . 53.1 p90 -117.67 145.48 44.36 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.08 0.467 . . . . 0.0 110.637 177.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 38.0 t-80 -99.29 -39.19 8.54 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.4 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 38.4 m -120.34 124.32 45.28 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.274 -176.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 55.9 ttt180 -117.85 118.69 32.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.822 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -117.84 115.86 25.82 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.084 0.468 . . . . 0.0 109.76 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.517 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 36.2 mt-10 -87.95 85.61 7.02 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.286 0.565 . . . . 0.0 110.544 -177.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.6 m -91.23 -6.62 53.08 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.633 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.412 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 50.1 t30 66.68 95.06 0.05 OUTLIER Pre-proline 0 N--CA 1.467 0.405 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.538 -176.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.412 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 61.4 Cg_endo -75.01 156.35 99.91 Favored 'Cis proline' 0 CA--C 1.534 0.482 0 C-N-CA 123.375 -1.51 . . . . 0.0 112.641 -0.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.3 Cg_exo -61.28 141.2 92.2 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.914 2.409 . . . . 0.0 112.686 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 20.9 t -132.29 141.51 49.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.863 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.442 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -138.32 130.78 29.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.668 0.27 . . . . 0.0 110.775 -179.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.6 m -83.68 119.76 25.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.186 -0.301 . . . . 0.0 110.186 179.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.547 HG22 ' HB3' ' A' ' 81' ' ' PHE . 44.9 pt -102.66 150.4 6.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.85 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -99.66 -48.96 4.55 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.101 177.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -140.67 169.7 17.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.457 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -155.72 158.11 37.68 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.887 0.375 . . . . 0.0 110.895 178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 78' ' ' LYS . 43.1 mt-10 -114.57 121.76 44.44 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.269 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 30.7 tp -72.9 121.48 20.08 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 75.2 mt -94.48 110.68 22.45 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.049 0.452 . . . . 0.0 110.49 -177.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 85.1 mt -69.85 160.4 31.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.494 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.486 ' HG2' ' H ' ' A' ' 103' ' ' HIS . 0.5 OUTLIER -97.55 -175.81 3.3 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.727 0.299 . . . . 0.0 110.227 -177.227 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.486 ' H ' ' HG2' ' A' ' 102' ' ' GLU . 77.2 t60 -83.44 -38.73 21.5 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.179 -178.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.9 m-70 -102.95 172.4 6.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.487 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 10.3 t-80 -89.73 -13.43 36.84 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.373 0.606 . . . . 0.0 109.502 173.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 51.8 m80 -116.5 157.12 25.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.301 177.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -107.11 -34.66 7.08 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.132 0.492 . . . . 0.0 109.774 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 9.8 m170 . . . . . 0 C--O 1.245 0.821 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.219 175.576 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.593 0.235 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -109.49 -16.66 13.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.762 0.315 . . . . 0.0 111.242 -176.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.8 mttp -111.62 -164.67 0.93 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.106 178.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -75.29 -21.2 58.66 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.091 0.472 . . . . 0.0 110.382 177.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -81.53 172.56 13.34 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.466 173.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -105.25 -72.06 0.72 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.689 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.0 t30 174.64 -48.95 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 O-C-N 123.813 0.695 . . . . 0.0 109.535 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -76.77 9.31 24.19 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.827 -178.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.81 -34.71 78.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.354 0.597 . . . . 0.0 109.845 178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -77.75 -36.67 50.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.726 -177.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.9 p -75.4 149.52 38.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.088 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.9 mttm -86.25 105.2 16.46 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.346 0.594 . . . . 0.0 110.925 179.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 75.2 mtp -90.86 128.61 36.8 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.232 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -90.74 130.24 36.75 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.791 0.329 . . . . 0.0 111.177 -174.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.6 m -79.34 129.12 34.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.905 179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 1.5 tt -128.46 116.88 20.39 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.2 t -98.79 122.59 50.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 177.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 155.97 26.65 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.466 -0.874 . . . . 0.0 112.38 -178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.44 ' O ' ' HA ' ' A' ' 30' ' ' LEU . 83.7 m-85 -83.99 127.87 34.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.675 0.274 . . . . 0.0 111.012 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.405 ' HA ' ' CD2' ' A' ' 30' ' ' LEU . 16.1 t -81.25 96.49 3.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.0 m -97.02 -36.92 6.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-O 120.858 0.361 . . . . 0.0 111.257 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.667 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 81.1 mt -140.25 147.15 39.57 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -135.94 140.9 44.36 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.4 -177.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 34.8 t70 -121.0 -175.11 2.98 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 174.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.415 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 46.9 t30 -82.32 -33.88 28.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.461 . . . . 0.0 110.169 176.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -95.3 -33.16 12.66 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.848 -177.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -139.31 164.92 28.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.918 0.39 . . . . 0.0 111.35 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.534 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -129.72 133.79 47.25 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.978 174.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.77 HG23 HD11 ' A' ' 57' ' ' ILE . 71.0 mt -90.65 107.04 18.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.026 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HA ' ' O ' ' A' ' 19' ' ' TYR . 40.6 mt -112.83 136.81 52.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.619 -177.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.586 HG22 ' H ' ' A' ' 33' ' ' ASP . 41.4 mt -95.33 120.04 44.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 174.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.431 HG22 HD21 ' A' ' 16' ' ' LEU . 20.6 p -90.25 22.89 3.11 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.969 -175.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.586 ' H ' HG22 ' A' ' 31' ' ' ILE . 7.4 t70 -97.31 -167.07 1.48 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.266 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.9 t -99.26 -23.44 15.19 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 121.222 0.534 . . . . 0.0 110.707 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mttm -87.1 140.02 29.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.923 -177.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -98.84 130.98 26.46 Favored Pre-proline 0 C--N 1.319 -0.743 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 168.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.475 ' HB3' ' CB ' ' A' ' 41' ' ' ASP . 57.3 Cg_exo -53.76 150.11 30.47 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.959 2.439 . . . . 0.0 112.876 -177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.72 -171.54 35.94 Favored Glycine 0 N--CA 1.441 -0.994 0 C-N-CA 120.635 -0.793 . . . . 0.0 111.996 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -56.06 -42.88 77.3 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 122.614 0.366 . . . . 0.0 110.843 -179.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.633 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 44.8 mt-10 -65.4 -41.22 93.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.944 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.475 ' CB ' ' HB3' ' A' ' 37' ' ' PRO . 16.0 m-20 -65.07 -44.74 87.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.414 -174.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -68.96 -19.08 64.16 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.863 0.363 . . . . 0.0 111.201 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -87.84 -23.68 23.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.547 -178.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.633 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 92.0 mt -69.03 158.69 34.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.136 178.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -70.78 149.08 47.23 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 50' ' ' MET . 0.0 OUTLIER -59.99 -31.64 70.11 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -172.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.01 -37.83 93.53 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.118 177.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 96.8 mt-30 -66.72 -49.04 67.32 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 177.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 47.3 tp -61.83 -40.91 96.93 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.413 178.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 46' ' ' GLU . 45.7 ttm -61.54 -33.77 74.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.785 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -81.19 -28.69 34.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.857 -178.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 48' ' ' GLN . 58.2 mtpt -64.18 -39.14 93.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.094 0.473 . . . . 0.0 110.291 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -113.46 43.39 1.77 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.64 178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 89.1 tttt -48.3 -37.71 17.07 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -171.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.401 HD22 ' HA ' ' A' ' 55' ' ' ASN . 11.5 m120 -116.72 13.53 15.16 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.346 -179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -121.91 25.13 9.31 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.352 0.596 . . . . 0.0 109.491 -178.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.77 HD11 HG23 ' A' ' 29' ' ' ILE . 10.2 tt -130.14 139.12 52.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.688 -176.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 38.7 t -127.76 123.81 61.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 174.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.59 ' O ' ' HA ' ' A' ' 91' ' ' SER . 58.6 mt -94.83 103.06 14.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 178.288 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.1 m -84.1 144.77 9.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.048 0.451 . . . . 0.0 111.329 -175.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.19 122.57 6.36 Favored Glycine 0 N--CA 1.444 -0.774 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.649 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.552 HD22 HG21 ' A' ' 68' ' ' THR . 63.4 mt -95.25 -4.03 46.47 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.778 0.34 . . . . 0.0 110.536 -177.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 4.4 m -59.26 -24.68 63.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.489 -177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -76.69 -38.58 54.17 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.49 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.442 HG22 ' H ' ' A' ' 67' ' ' ASN . 45.9 mt -106.68 100.14 10.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.996 0.427 . . . . 0.0 110.887 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -80.23 8.36 7.53 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.148 0.499 . . . . 0.0 110.7 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.442 ' H ' HG22 ' A' ' 65' ' ' ILE . 17.6 m120 -104.02 12.51 34.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.838 -177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.552 HG21 HD22 ' A' ' 62' ' ' LEU . 5.3 p -81.84 26.03 0.52 Allowed 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -174.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -70.2 -36.63 74.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.868 0.366 . . . . 0.0 111.301 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.63 6.05 29.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.252 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.536 HD11 HD13 ' A' ' 77' ' ' ILE . 14.3 tp -71.54 115.83 11.18 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.944 0.402 . . . . 0.0 110.079 -179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 73' ' ' ARG . 43.3 tttm -100.9 140.86 34.6 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.512 -174.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.465 ' O ' ' HG2' ' A' ' 72' ' ' LYS . 74.1 mtt180 -72.78 152.53 41.54 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.283 173.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 74.29 41.39 38.24 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.696 178.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -143.24 -166.05 2.22 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 -177.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HB2' ' A' ' 100' ' ' LEU . 63.1 pttt -144.28 145.45 32.03 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.542 HG22 ' HA ' ' A' ' 99' ' ' LEU . 25.5 pt -135.47 152.08 31.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.268 0.556 . . . . 0.0 111.313 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -104.8 106.71 17.32 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.844 173.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 30.7 m -103.92 155.58 5.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-O 120.881 0.372 . . . . 0.0 111.434 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 6.6 m-90 -113.43 111.59 22.21 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.432 172.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.431 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 2.4 p90 -115.43 163.66 15.41 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.36 -175.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.34 -60.84 0.99 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.738 -178.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 p -93.45 133.4 36.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.152 0.501 . . . . 0.0 111.547 -177.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -115.91 117.11 29.27 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.365 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.713 ' HB2' ' HB2' ' A' ' 91' ' ' SER . 67.2 mttm -85.97 135.28 33.72 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.962 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -92.6 42.52 1.1 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.995 -173.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 43.9 t -68.65 -31.84 71.25 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.843 -179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 48.6 t30 64.39 102.38 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.428 0 O-C-N 123.611 0.569 . . . . 0.0 110.705 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 27.2 Cg_exo -63.18 152.12 69.66 Favored 'Cis proline' 0 C--N 1.347 0.452 0 C-N-CA 124.076 -1.218 . . . . 0.0 113.022 2.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 45.6 Cg_exo -55.95 130.1 38.52 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 123.015 2.477 . . . . 0.0 112.275 -178.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.713 ' HB2' ' HB2' ' A' ' 85' ' ' LYS . 13.3 m -105.44 116.06 31.31 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.082 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -104.09 116.05 31.52 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.731 0.3 . . . . 0.0 111.215 -176.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 26.1 m -76.88 114.6 15.84 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 177.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 38.9 pt -96.65 139.04 20.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.915 0.388 . . . . 0.0 111.192 -175.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -104.81 -25.87 12.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.786 -178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -147.72 163.64 36.06 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.639 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 2.6 p90 -162.01 150.35 15.0 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.989 0.423 . . . . 0.0 111.572 179.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -114.75 123.09 48.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.763 173.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.542 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -75.32 110.97 10.12 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.088 177.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.529 ' HB2' ' HG3' ' A' ' 76' ' ' LYS . 86.3 mt -91.49 107.26 19.09 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.105 0.479 . . . . 0.0 110.679 -177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.7 mt -90.55 145.35 24.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.649 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.451 ' OE1' ' HE2' ' A' ' 76' ' ' LYS . 10.3 mm-40 -86.71 -43.52 12.52 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.948 -175.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -98.95 133.61 42.98 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.759 0.314 . . . . 0.0 110.173 -177.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -132.36 133.46 43.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.857 -177.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -85.07 170.99 12.41 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.924 0.392 . . . . 0.0 110.556 -178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 54.7 m80 -86.87 -7.8 57.87 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.24 0.543 . . . . 0.0 110.091 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -99.79 18.81 17.3 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 171.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 55.1 p-80 . . . . . 0 C--O 1.249 1.036 0 CA-C-N 114.163 -1.381 . . . . 0.0 112.387 -179.508 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.417 ' HB2' ' OD1' ' A' ' 4' ' ' ASN . 82.4 mtp . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -91.29 1.49 57.07 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.008 0.432 . . . . 0.0 110.733 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.9 mttp -96.88 -3.81 41.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.698 176.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.417 ' OD1' ' HB2' ' A' ' 1' ' ' MET . 18.2 m120 -70.29 -55.04 10.19 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.438 177.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -108.06 118.97 38.15 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.64 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -76.55 100.49 5.31 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.031 0.444 . . . . 0.0 110.788 -174.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -68.16 126.23 28.87 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.653 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -145.2 -165.11 11.04 Favored Glycine 0 N--CA 1.446 -0.688 0 N-CA-C 111.574 -0.611 . . . . 0.0 111.574 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -70.47 117.4 11.96 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -53.43 -62.33 1.72 Allowed 'General case' 0 C--O 1.234 0.288 0 O-C-N 123.877 0.736 . . . . 0.0 110.965 179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.2 m -79.18 105.97 10.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.57 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -72.12 113.49 9.21 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.098 0.475 . . . . 0.0 109.952 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.494 ' HB2' ' HB3' ' A' ' 80' ' ' TRP . 61.5 mtm -86.78 164.36 16.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.594 -173.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -83.2 126.81 33.04 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.675 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 4.2 m -91.61 132.12 36.55 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.891 -176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.438 HD12 HG22 ' A' ' 32' ' ' THR . 0.2 OUTLIER -137.26 130.3 30.68 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.399 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 66.5 t -99.22 126.41 52.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.331 -179.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.68 169.15 29.23 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.218 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.476 ' CE2' ' HD2' ' A' ' 76' ' ' LYS . 87.7 m-85 -103.25 135.51 44.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.849 0.357 . . . . 0.0 110.769 -178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 18.5 t -86.77 96.18 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.046 -178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.5 t -96.11 -53.32 8.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.608 -179.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.85 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 92.8 mt -116.5 136.19 53.19 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.977 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 tttm -126.88 130.18 49.67 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.209 0.528 . . . . 0.0 111.01 -178.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -105.38 175.53 5.47 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -74.49 -34.33 63.06 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.784 0.326 . . . . 0.0 110.614 179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -119.23 -0.32 11.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.579 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -143.18 165.29 27.84 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.717 0.294 . . . . 0.0 110.581 -175.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.429 ' HB3' ' CG2' ' A' ' 60' ' ' VAL . . . -138.89 122.31 17.21 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.859 0.362 . . . . 0.0 110.074 176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.85 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 53.6 mt -90.9 99.33 9.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 CA-C-O 121.243 0.544 . . . . 0.0 109.637 -178.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 37.7 mt -108.94 139.08 44.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.711 -173.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.3 mt -87.67 114.21 26.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.438 HG22 HD12 ' A' ' 16' ' ' LEU . 6.0 p -80.08 -16.19 55.54 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.314 -178.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -78.05 119.42 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' HE1' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -80.56 69.85 7.15 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.861 0.689 . . . . 0.0 112.861 -171.186 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -128.99 120.31 25.82 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 168.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -67.15 114.12 16.87 Favored Pre-proline 0 C--N 1.327 -0.377 0 O-C-N 123.109 0.256 . . . . 0.0 110.799 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 11.4 Cg_exo -70.92 156.99 59.34 Favored 'Trans proline' 0 N--CA 1.462 -0.353 0 C-N-CA 123.016 2.477 . . . . 0.0 112.158 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -97.22 -178.09 34.46 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.769 178.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 66.0 tttp -58.25 -38.51 77.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.905 0.383 . . . . 0.0 110.746 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.456 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.6 mp0 -60.93 -40.44 93.24 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.474 177.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -72.92 -34.73 66.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.542 -177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -72.9 -20.08 61.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.613 175.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -82.1 -26.14 33.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.032 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.0 mt -61.96 145.17 53.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.642 177.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.5 m -88.32 -179.83 6.2 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.999 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.553 ' CD ' ' H ' ' A' ' 46' ' ' GLU . 23.7 mp0 -54.24 -61.48 2.28 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.57 -172.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.23 -34.2 83.43 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.536 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -66.38 -41.26 89.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.838 0.352 . . . . 0.0 110.287 -179.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 84.1 mt -73.2 -33.36 65.35 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.657 176.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.564 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 66.1 mtt -64.4 -24.42 67.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.415 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.9 m-80 -90.35 -31.5 16.87 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.5 177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -78.37 -38.9 40.78 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.184 0.516 . . . . 0.0 110.261 -179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -113.59 55.39 0.72 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 50' ' ' MET . 20.8 tttt -61.38 112.67 2.27 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.469 -171.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 65.45 11.68 7.56 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.786 -178.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 88.9 m-20 -107.9 9.08 28.82 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 121.771 0.796 . . . . 0.0 109.199 174.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.562 HD11 HG22 ' A' ' 29' ' ' ILE . 18.8 tt -123.99 132.52 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 114.667 -1.152 . . . . 0.0 109.117 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.522 HG22 ' HB2' ' A' ' 90' ' ' PRO . 98.7 t -120.07 125.85 74.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 120.994 0.426 . . . . 0.0 110.981 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.402 HG12 HG12 ' A' ' 29' ' ' ILE . 56.4 mt -91.85 96.43 6.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 176.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.429 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.0 m -76.01 147.54 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.211 0.529 . . . . 0.0 110.704 -177.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -93.87 119.87 6.14 Favored Glycine 0 N--CA 1.441 -1.007 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.769 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.531 HD13 HG21 ' A' ' 68' ' ' THR . 64.6 mt -89.1 27.08 1.44 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -59.58 -38.25 80.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.371 -176.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.708 ' HG3' ' HG2' ' A' ' 95' ' ' GLN . 26.0 mm-40 -92.72 -9.38 40.91 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.687 -176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.422 HG22 HG23 ' A' ' 68' ' ' THR . 50.2 mt -117.36 104.64 16.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.044 0.449 . . . . 0.0 111.008 -175.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -82.23 -38.59 24.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.731 -178.115 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -81.01 47.99 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.446 0.641 . . . . 0.0 111.252 -175.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.531 HG21 HD13 ' A' ' 62' ' ' LEU . 2.2 p -85.36 18.39 2.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.573 177.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -73.99 -24.74 59.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.527 -0.761 . . . . 0.0 109.576 174.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -68.14 -26.33 65.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.928 174.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 37.0 tp -83.42 121.48 27.23 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 9.1 mtmp? -119.29 165.53 14.16 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.903 0.382 . . . . 0.0 110.821 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.0 ttt85 -83.76 127.42 33.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.81 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.74 42.48 2.47 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.068 -179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -134.06 -171.15 2.67 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.177 0.513 . . . . 0.0 111.455 -177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.476 ' HD2' ' CE2' ' A' ' 19' ' ' TYR . 83.6 tttt -138.69 129.52 26.48 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.107 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 30.5 pt -136.74 166.65 25.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-O 121.663 0.744 . . . . 0.0 112.586 -175.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.536 ' HB2' HD11 ' A' ' 100' ' ' LEU . 55.8 tttt -122.56 106.98 11.48 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.247 -1.342 . . . . 0.0 108.309 177.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.527 ' HB ' HG21 ' A' ' 94' ' ' ILE . 30.1 m -98.41 149.34 5.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 120.988 0.423 . . . . 0.0 112.139 -171.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.494 ' HB3' ' HB2' ' A' ' 13' ' ' MET . 5.6 m-90 -114.53 106.23 14.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.393 172.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.459 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.8 p90 -108.97 135.31 50.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.32 0.581 . . . . 0.0 111.106 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 -91.61 -48.9 6.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.018 178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.454 ' CG2' ' HB ' ' A' ' 93' ' ' THR . 8.6 t -104.68 126.64 51.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.281 0.562 . . . . 0.0 110.243 179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 35.5 ttt180 -112.39 138.46 49.1 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.164 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.673 ' HB2' ' HB3' ' A' ' 91' ' ' SER . 58.9 mttm -118.04 134.28 55.13 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.0 0.428 . . . . 0.0 110.379 -178.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -110.02 56.5 0.62 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.485 0.659 . . . . 0.0 109.544 177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 p -73.23 -23.36 60.35 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.53 -179.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 63.87 99.78 0.04 OUTLIER Pre-proline 0 N--CA 1.472 0.629 0 C-N-CA 123.252 0.621 . . . . 0.0 111.293 179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 34.0 Cg_endo -63.73 147.22 63.4 Favored 'Cis proline' 0 C--N 1.349 0.564 0 C-N-CA 123.717 -1.368 . . . . 0.0 112.585 1.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 58' ' ' VAL . 34.8 Cg_exo -57.14 152.67 43.45 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.03 2.486 . . . . 0.0 113.082 -176.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB3' ' HB2' ' A' ' 85' ' ' LYS . 26.3 t -134.81 161.06 36.26 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.357 -179.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -158.26 110.08 2.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.618 0.246 . . . . 0.0 110.599 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.454 ' HB ' ' CG2' ' A' ' 83' ' ' THR . 38.5 m -73.89 113.64 11.28 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.912 0.387 . . . . 0.0 110.09 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.527 HG21 ' HB ' ' A' ' 79' ' ' VAL . 31.8 pt -100.03 138.4 24.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.008 -177.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.708 ' HG2' ' HG3' ' A' ' 64' ' ' GLU . 39.7 mt-30 -104.85 -10.87 17.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.246 178.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -159.74 144.16 14.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.491 -176.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.415 ' CD1' HD13 ' A' ' 65' ' ' ILE . 5.1 p90 -147.59 152.73 38.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.015 0.435 . . . . 0.0 111.12 179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -114.56 144.17 43.81 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.326 -0.852 . . . . 0.0 109.092 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 51.2 tp -93.25 136.62 33.35 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 -178.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.536 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.6 mt -123.69 90.95 3.37 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.772 0.32 . . . . 0.0 110.182 178.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.0 mt -82.01 147.67 29.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.932 0.396 . . . . 0.0 111.375 -177.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -62.05 -43.62 98.45 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.401 177.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -99.42 114.97 28.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.158 -178.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 57.0 m80 -94.1 -17.07 23.2 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.763 -177.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -115.36 107.27 15.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -78.22 98.17 5.78 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.883 -172.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 37.7 t60 -98.0 -45.48 6.25 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.842 -1.169 . . . . 0.0 107.842 168.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 8.0 m-70 . . . . . 0 C--O 1.245 0.854 0 CA-C-N 114.568 -1.196 . . . . 0.0 109.363 174.387 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.1 mtm . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 120.836 0.351 . . . . 0.0 110.394 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -87.53 122.5 31.32 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -83.47 -14.21 52.95 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.753 -175.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -88.63 173.18 8.77 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.808 0.337 . . . . 0.0 110.277 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.24 131.4 34.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.001 0.429 . . . . 0.0 110.063 179.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -82.51 -36.29 26.56 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.607 -178.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.9 t30 50.67 44.25 27.61 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.926 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -64.8 161.68 39.7 Favored Glycine 0 N--CA 1.448 -0.536 0 CA-C-N 115.456 -0.793 . . . . 0.0 112.521 -177.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -62.43 156.12 23.54 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.485 0.183 . . . . 0.0 110.615 -178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 65.49 43.28 3.44 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 -171.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 10.9 m -63.1 112.09 2.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.589 -1.187 . . . . 0.0 111.195 -177.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -75.99 111.51 11.45 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.725 175.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.46 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 67.5 mtm -85.38 150.78 24.5 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.644 -176.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -83.85 125.89 32.42 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.717 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 6.5 t -109.55 141.16 42.44 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.378 -173.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.443 ' O ' ' HA ' ' A' ' 78' ' ' LYS . 67.9 mt -139.41 146.82 40.62 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.276 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 96.7 t -97.08 127.96 48.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 171.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 157.47 27.31 Favored Glycine 0 N--CA 1.445 -0.754 0 C-N-CA 119.952 -1.118 . . . . 0.0 112.819 -176.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.403 ' HE1' ' HE3' ' A' ' 76' ' ' LYS . 65.3 m-85 -94.66 125.51 39.36 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.465 -0.368 . . . . 0.0 110.308 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.51 104.73 11.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.47 HG11 HD21 ' A' ' 49' ' ' LEU . 7.1 p -100.66 -42.04 9.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 C-N-CA 121.071 -0.252 . . . . 0.0 110.861 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.747 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 66.8 mt -129.34 154.81 46.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.644 0.259 . . . . 0.0 110.42 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -148.44 142.11 25.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.09 0.471 . . . . 0.0 111.171 -176.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' CG ' ' H ' ' A' ' 25' ' ' ASN . 13.8 t70 -123.14 -155.72 0.67 Allowed 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 171.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.425 ' H ' ' CG ' ' A' ' 24' ' ' ASP . 6.9 t30 -102.76 -31.3 10.39 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -91.66 -35.61 14.1 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.92 179.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 38.8 ptt85 -135.88 165.64 25.16 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.171 -174.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.37 149.69 45.82 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.751 174.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.747 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 42.0 mt -106.41 111.55 35.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 120.957 0.408 . . . . 0.0 110.488 -179.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.6 mt -111.76 141.94 44.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.462 -178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.3 mt -106.71 118.79 55.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 174.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.3 p -79.65 120.66 24.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.231 178.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.6 m-20 60.82 -162.43 0.27 Allowed 'General case' 0 N--CA 1.463 0.217 0 O-C-N 123.665 0.603 . . . . 0.0 110.379 -179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m 76.94 14.26 2.06 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.314 174.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 62.96 -174.62 0.15 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.356 -178.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.437 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -84.09 135.42 42.12 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.292 178.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 32.2 Cg_exo -58.9 158.47 24.76 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.903 2.402 . . . . 0.0 112.452 179.394 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -78.5 174.08 55.15 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.266 -178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -62.07 -39.84 93.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.838 0.352 . . . . 0.0 110.804 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 1.9 mp0 -65.05 -34.14 77.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.326 178.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -64.64 -36.6 84.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.698 -178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -75.57 -5.02 43.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.02 0.438 . . . . 0.0 111.042 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.408 HD22 ' HA ' ' A' ' 43' ' ' ASN . 10.3 m120 -109.16 -8.24 15.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.65 177.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 91.1 mt -76.34 148.48 37.43 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 175.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.9 p -75.69 165.05 25.63 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.669 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -55.09 -47.45 74.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.537 -173.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.52 -46.02 93.73 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.608 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -60.86 -44.82 96.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.894 0.378 . . . . 0.0 110.624 179.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.47 HD21 HG11 ' A' ' 21' ' ' VAL . 25.1 tp -62.78 -43.94 97.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.724 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.41 ' HG2' ' CD1' ' A' ' 57' ' ' ILE . 87.3 mtp -64.68 -22.98 67.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.428 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.4 m-20 -93.49 -9.56 37.98 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 179.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -94.54 -50.7 5.08 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.998 0.427 . . . . 0.0 110.339 179.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -102.55 40.07 1.42 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -57.83 -29.78 65.21 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.951 -1.022 . . . . 0.0 112.897 -169.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -93.94 -23.76 17.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -109.41 11.42 25.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.745 0.307 . . . . 0.0 111.615 -175.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CD1' ' HG2' ' A' ' 50' ' ' MET . 10.7 tt -91.65 125.04 44.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.3 0.571 . . . . 0.0 110.722 179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.0 t -118.84 120.43 64.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.942 176.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 66.1 mt -92.43 101.88 13.02 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 177.202 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -86.22 140.1 16.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.226 0.536 . . . . 0.0 111.236 -176.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -92.17 125.89 8.28 Favored Glycine 0 N--CA 1.444 -0.797 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.292 177.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HG21 ' A' ' 68' ' ' THR . 63.2 mt -94.44 14.43 20.68 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.091 0.472 . . . . 0.0 110.531 -176.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.4 m -60.08 -28.46 67.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.845 -176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 94' ' ' ILE . 17.3 mm-40 -89.39 -3.44 58.44 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.442 -176.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.454 HG22 ' H ' ' A' ' 67' ' ' ASN . 26.5 mt -119.58 117.67 54.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.105 0.479 . . . . 0.0 110.249 -177.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -86.12 7.83 23.27 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.403 0.621 . . . . 0.0 111.136 -174.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.454 ' H ' HG22 ' A' ' 65' ' ' ILE . 23.5 t-20 -153.94 83.77 1.15 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.168 -176.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.525 HG21 HD22 ' A' ' 62' ' ' LEU . 1.2 p -119.77 13.16 12.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.445 0.64 . . . . 0.0 110.614 177.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -72.98 -9.12 58.39 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.764 -175.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -92.68 5.86 49.51 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.081 -0.387 . . . . 0.0 111.049 -179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 14.7 tp -90.57 140.85 29.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.221 178.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.494 ' HD3' ' CD ' ' A' ' 75' ' ' GLU . 6.6 mptt -124.58 -178.52 4.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -93.17 123.23 36.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.052 174.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 102.61 42.69 2.11 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.556 178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.494 ' CD ' ' HD3' ' A' ' 72' ' ' LYS . 53.9 mt-10 -128.3 177.84 6.67 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.896 0.379 . . . . 0.0 110.947 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.403 ' HE3' ' HE1' ' A' ' 19' ' ' TYR . 59.9 mttp -121.05 135.19 55.25 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 174.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.463 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.2 pt -137.62 152.99 27.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.334 0.588 . . . . 0.0 111.483 177.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.443 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 82.8 tttt -110.2 107.28 17.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.605 176.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.717 ' O ' ' HA ' ' A' ' 15' ' ' SER . 27.3 m -95.17 154.65 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -170.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.46 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 12.7 m-90 -125.78 123.38 38.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.714 -0.675 . . . . 0.0 109.636 172.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.554 ' HB3' HG22 ' A' ' 94' ' ' ILE . 55.5 p90 -140.07 171.35 14.31 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.003 0.43 . . . . 0.0 111.089 178.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 62.8 t60 -147.27 -35.8 0.23 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.494 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 2.5 m -76.47 98.78 4.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.063 175.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 39.0 ttt180 -94.73 120.95 35.77 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.406 -179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.3 tttp -119.8 139.35 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -179.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -121.57 101.62 7.72 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 120.464 -0.495 . . . . 0.0 110.864 -177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 38.5 t -104.8 -11.66 16.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.311 177.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.414 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 49.4 t-20 65.65 99.51 0.04 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 O-C-N 124.078 0.861 . . . . 0.0 109.675 -174.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.414 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 68.6 Cg_endo -72.28 171.4 63.33 Favored 'Cis proline' 0 CA--C 1.537 0.658 0 C-N-CA 124.004 -1.248 . . . . 0.0 113.227 3.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -55.73 140.61 84.7 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.02 2.48 . . . . 0.0 112.798 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 10.8 p -130.04 115.75 17.56 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.417 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -107.4 125.05 50.72 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 120.764 0.316 . . . . 0.0 110.884 -176.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.585 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 24.3 m -84.62 107.56 16.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.554 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.0 pt -96.44 139.46 19.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.113 -174.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -103.14 -5.32 23.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.539 179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -173.26 151.34 2.03 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.734 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 38.6 p90 -143.84 163.4 33.49 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 172.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.61 120.99 42.06 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.463 ' HA ' HG22 ' A' ' 77' ' ' ILE . 37.0 tp -75.24 109.71 8.97 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.961 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.614 HD22 ' HB2' ' A' ' 107' ' ' HIS . 43.5 mt -82.27 84.0 7.24 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.066 0.46 . . . . 0.0 110.533 -176.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.6 mt -63.67 132.14 50.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.688 175.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -82.51 28.49 0.47 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.161 0.505 . . . . 0.0 111.45 -170.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -87.68 -26.21 23.1 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -135.12 130.71 35.89 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 170.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -81.65 -8.83 59.75 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.785 0.326 . . . . 0.0 111.609 -169.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -127.75 110.46 12.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.869 0.366 . . . . 0.0 110.044 174.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . 0.614 ' HB2' HD22 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -93.53 156.76 16.56 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.157 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 9.4 p80 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.058 177.666 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.432 ' HG2' ' OD1' ' A' ' 4' ' ' ASN . 57.6 ttp . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -98.91 -52.37 3.59 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.379 -175.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.0 pttp -71.33 -29.51 65.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.718 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.432 ' OD1' ' HG2' ' A' ' 1' ' ' MET . 88.7 m-20 64.82 14.53 9.25 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.477 0.485 . . . . 0.0 111.36 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 9' ' ' ASP . 10.6 tp10 -98.97 145.97 26.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.328 -177.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -56.98 -48.44 78.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.857 -173.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -55.92 108.17 0.42 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.905 -176.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.35 47.7 89.79 Favored Glycine 0 N--CA 1.449 -0.465 0 CA-C-N 115.621 -0.718 . . . . 0.0 113.347 174.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 5' ' ' GLU . 1.1 t70 -98.57 -162.75 0.98 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 174.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.99 -68.42 0.39 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.724 0.297 . . . . 0.0 111.64 -176.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.3 m -107.47 137.5 45.4 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.127 -176.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 82.0 tttt -65.05 116.52 6.54 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 173.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.532 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 53.1 mtp -107.83 119.02 38.26 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.885 0.374 . . . . 0.0 110.495 -177.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.417 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 13.4 mp0 -83.79 161.63 20.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.055 178.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 m -102.85 128.66 49.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.922 0.391 . . . . 0.0 111.45 -175.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.617 ' HB2' ' CE1' ' A' ' 81' ' ' PHE . 4.7 tt -116.7 109.5 17.24 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.8 t -93.9 117.78 38.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.52 158.69 27.77 Favored Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 120.51 -0.852 . . . . 0.0 112.473 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -96.25 127.82 42.61 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.0 t -75.92 97.3 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.9 p -103.4 -37.5 4.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.278 -176.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 29' ' ' ILE . 36.8 tp -136.26 126.69 26.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' HB2' ' A' ' 71' ' ' LEU . 62.4 tttm -146.46 125.54 12.88 Favored 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 121.039 -0.265 . . . . 0.0 110.664 -177.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -83.78 -70.41 0.57 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.106 0.479 . . . . 0.0 110.245 176.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -154.68 -60.59 0.12 Allowed 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -97.61 -20.2 17.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.928 -178.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 27' ' ' ARG . 19.8 mtm180 -104.13 123.88 48.08 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.967 0.413 . . . . 0.0 110.954 -179.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.521 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -111.05 112.92 25.08 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.956 176.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.736 HD12 HD23 ' A' ' 22' ' ' LEU . 54.1 mt -86.03 109.46 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.473 177.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 44.4 mt -111.22 143.01 42.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.688 -175.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 24.9 mt -104.97 123.0 58.79 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 172.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p -76.78 101.23 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.548 -177.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.3 t70 64.28 101.77 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.812 0.695 . . . . 0.0 111.364 177.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.15 -7.24 4.85 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.057 -174.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.9 mttp 56.36 40.2 29.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 -174.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 65.25 102.84 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.289 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.503 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -50.72 -63.52 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.186 2.591 . . . . 0.0 112.849 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.7 148.69 5.44 Favored Glycine 0 N--CA 1.443 -0.859 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.757 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.4 tmtt? -61.21 -37.71 83.95 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.477 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.8 -26.64 44.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.5 179.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.543 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 2.3 m-20 -65.41 -32.2 73.7 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.762 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -69.66 -14.19 62.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.918 0.389 . . . . 0.0 110.63 176.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -99.6 -18.07 17.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' HA ' ' A' ' 41' ' ' ASP . 87.6 mt -63.26 149.91 44.44 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.029 0.442 . . . . 0.0 110.989 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -76.25 171.26 14.83 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.871 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.411 ' O ' ' HG3' ' A' ' 50' ' ' MET . 41.9 tt0 -56.27 -54.62 43.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.346 -176.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -59.03 -37.5 91.67 Favored Glycine 0 C--N 1.329 0.179 0 C-N-CA 121.123 -0.56 . . . . 0.0 112.469 -178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -65.28 -43.37 91.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.984 0.421 . . . . 0.0 110.443 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 88.5 mt -68.23 -40.02 82.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.948 177.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 46' ' ' GLU . 85.5 mtp -66.49 -23.09 66.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.998 -177.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.59 -34.12 14.15 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.974 178.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -76.66 -43.9 36.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.912 0.387 . . . . 0.0 111.057 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -110.09 39.82 2.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.871 0.844 . . . . 0.0 109.107 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.419 ' O ' HG22 ' A' ' 57' ' ' ILE . 26.7 ttpt -53.93 -48.64 70.01 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 113.671 -1.604 . . . . 0.0 113.723 -170.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -86.51 0.52 54.1 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.558 0.577 . . . . 0.0 112.558 -175.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -124.98 17.99 8.5 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.709 -176.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 89' ' ' PRO . 13.6 tt -103.36 124.14 57.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-O 121.193 0.521 . . . . 0.0 111.74 -176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.534 HG22 ' HG2' ' A' ' 90' ' ' PRO . 70.1 t -124.33 137.54 56.88 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.301 177.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.657 HD12 HG12 ' A' ' 29' ' ' ILE . 13.3 mm -104.2 100.86 11.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.142 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.418 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 34.3 m -89.01 139.95 16.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.257 0.551 . . . . 0.0 111.046 -179.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -94.36 117.2 5.47 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.948 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 68' ' ' THR . 49.0 mt -95.75 11.03 34.96 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 122.626 0.37 . . . . 0.0 110.562 -178.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 51.1 m -63.93 -14.83 56.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -174.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.441 ' OE2' ' HG2' ' A' ' 95' ' ' GLN . 27.5 tt0 -96.72 -3.33 42.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.21 0.529 . . . . 0.0 110.418 178.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.463 ' CG2' HG23 ' A' ' 68' ' ' THR . 31.1 mt -113.23 109.92 30.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.91 11.36 9.51 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.814 -168.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -136.9 24.01 3.07 Favored 'General case' 0 C--N 1.327 -0.412 0 O-C-N 122.207 -0.308 . . . . 0.0 111.763 -177.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.556 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.7 p -80.43 37.73 0.41 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -87.78 -21.22 25.24 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.046 0.451 . . . . 0.0 110.623 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -73.95 -17.73 60.97 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.976 -174.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.521 ' HB2' ' HE3' ' A' ' 23' ' ' LYS . 3.2 mm? -71.31 122.79 20.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.745 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mttp -108.01 171.19 7.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.424 -179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -86.4 117.9 25.5 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 109.43 33.56 2.68 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.759 -177.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -127.63 -177.48 4.11 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -135.13 135.0 40.81 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.155 -0.313 . . . . 0.0 110.155 -175.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.54 HG22 ' HA ' ' A' ' 99' ' ' LEU . 32.1 pt -137.93 151.45 25.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.432 0.634 . . . . 0.0 111.7 179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.438 ' HB2' HD11 ' A' ' 100' ' ' LEU . 47.9 tttm -115.33 106.75 14.38 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.541 172.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.447 ' CG2' ' HB3' ' A' ' 16' ' ' LEU . 30.1 m -100.77 154.15 4.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.323 -174.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.532 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 3.2 m-90 -104.81 119.46 39.05 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.642 174.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.617 ' CE1' ' HB2' ' A' ' 16' ' ' LEU . 1.0 OUTLIER -136.79 171.99 13.67 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.906 -175.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -164.57 -35.33 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.465 -0.789 . . . . 0.0 108.892 175.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 93' ' ' THR . 0.2 OUTLIER -75.3 90.68 2.63 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.991 174.506 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 84' ' ' ARG . 23.0 ttt180 -108.45 117.84 35.2 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.131 0.491 . . . . 0.0 110.787 -177.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -112.47 94.51 4.96 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.399 -0.819 . . . . 0.0 108.839 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.767 ' HG3' ' HB3' ' A' ' 90' ' ' PRO . 27.3 tt0 -85.47 109.71 18.66 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.362 0.601 . . . . 0.0 111.283 -173.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p -108.68 -11.63 15.05 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.583 176.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.0 t30 62.01 96.18 0.05 OUTLIER Pre-proline 0 N--CA 1.466 0.354 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.433 -173.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.448 ' HB3' HG23 ' A' ' 57' ' ' ILE . 39.4 Cg_endo -66.63 144.1 66.91 Favored 'Cis proline' 0 C--N 1.344 0.317 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.677 1.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.767 ' HB3' ' HG3' ' A' ' 86' ' ' GLU . 41.4 Cg_endo -68.7 139.87 45.3 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.715 2.277 . . . . 0.0 112.656 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.452 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 29.8 t -111.28 153.45 25.9 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.21 131.18 19.23 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.682 0.277 . . . . 0.0 111.074 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 83' ' ' THR . 11.9 m -85.91 126.89 34.43 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.559 HG22 ' HB3' ' A' ' 81' ' ' PHE . 31.3 pt -117.47 153.04 19.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.519 -178.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.441 ' HG2' ' OE2' ' A' ' 64' ' ' GLU . 80.0 mt-30 -110.6 -38.17 5.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.035 176.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 52.7 mttp -130.8 150.91 51.76 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.736 -172.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 1.7 p90 -152.07 154.1 35.27 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.009 0.433 . . . . 0.0 110.712 -179.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.411 ' OE2' ' HD3' ' A' ' 78' ' ' LYS . 42.0 mt-10 -117.21 114.34 23.51 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.502 175.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.54 ' HA ' HG22 ' A' ' 77' ' ' ILE . 65.1 tp -71.38 104.41 3.19 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 175.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.438 HD11 ' HB2' ' A' ' 78' ' ' LYS . 73.1 mt -78.71 90.97 4.62 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 45.7 tp -66.49 93.33 0.23 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.965 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.41 ' OE1' ' HB2' ' A' ' 104' ' ' HIS . 2.6 tm-20 -57.34 116.76 3.51 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 174.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 45.8 m80 -80.25 21.08 0.62 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -166.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.41 ' HB2' ' OE1' ' A' ' 102' ' ' GLU . 57.4 m80 -128.67 -58.54 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.334 174.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 22.0 m80 61.21 -166.4 0.21 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 -173.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -128.92 56.61 1.66 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.536 0.684 . . . . 0.0 110.024 172.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -145.48 7.83 1.15 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.065 177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 65.1 t60 . . . . . 0 C--O 1.25 1.083 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.768 -172.542 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.8 mtt . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.583 0.23 . . . . 0.0 110.587 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 134.32 56.68 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.939 -178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.415 ' HD3' ' HA ' ' A' ' 3' ' ' LYS . 11.0 mmtm -88.41 146.86 25.0 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.019 0.437 . . . . 0.0 110.886 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.588 ' OD1' ' HE3' ' A' ' 12' ' ' LYS . 33.8 t30 -117.05 127.05 53.78 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.788 -176.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -93.39 -2.15 55.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.152 -178.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -103.61 145.7 29.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.027 -179.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -96.38 91.97 6.09 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 159.29 57.16 0.01 OUTLIER Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 110.321 -1.112 . . . . 0.0 110.321 -175.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.23 -21.49 64.83 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.112 -0.544 . . . . 0.0 110.917 -174.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -64.05 -31.47 72.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.933 -177.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.5 m -72.16 -19.94 61.68 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 121.348 0.594 . . . . 0.0 110.491 179.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.588 ' HE3' ' OD1' ' A' ' 4' ' ' ASN . 68.0 mttm -88.36 112.7 23.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.39 0.614 . . . . 0.0 110.652 -178.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 69.3 mtp -111.21 140.33 45.86 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.352 -0.84 . . . . 0.0 109.135 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 95.4 mt-30 -83.84 119.56 25.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.321 -177.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 8.9 t -83.59 109.89 17.8 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 -178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD11 HG22 ' A' ' 32' ' ' THR . 3.2 tm? -116.52 119.31 35.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.693 -178.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.444 HG22 ' HG3' ' A' ' 78' ' ' LYS . 30.5 t -94.08 129.65 44.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 177.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.57 162.8 28.93 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.656 -176.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.414 ' HE1' ' HA ' ' A' ' 33' ' ' ASP . 94.8 m-85 -100.89 126.46 47.51 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.391 -0.225 . . . . 0.0 110.391 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.71 91.4 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.705 178.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.494 HG23 ' CE1' ' A' ' 42' ' ' TYR . 2.9 p -93.15 -39.48 11.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.674 179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.745 HD23 HD12 ' A' ' 29' ' ' ILE . 39.8 tp -130.27 133.01 46.18 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -131.37 137.47 48.74 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.827 0.346 . . . . 0.0 110.338 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -119.16 -176.98 3.24 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.22 -37.68 52.84 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -94.54 -37.31 11.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.782 -175.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -137.56 174.75 10.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.983 -174.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.419 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -145.89 149.24 33.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.511 176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.745 HD12 HD23 ' A' ' 22' ' ' LEU . 42.3 mt -106.25 115.92 48.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.078 178.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.0 mt -110.09 138.48 46.42 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.404 -178.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.8 mt -95.21 118.51 41.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 174.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.533 HG22 HD11 ' A' ' 16' ' ' LEU . 14.5 p -79.93 89.7 5.32 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.226 -174.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.414 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 38.5 t70 55.5 86.91 0.05 Allowed 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.074 -0.966 . . . . 0.0 112.442 171.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.9 m -148.44 31.63 0.81 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.521 0.677 . . . . 0.0 110.064 178.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 83.7 tttt 63.91 28.05 14.5 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.269 178.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . 62.44 150.9 0.11 Allowed Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 114.241 -1.345 . . . . 0.0 112.67 178.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.483 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 95.3 Cg_endo -81.26 161.41 20.17 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.205 1.937 . . . . 0.0 111.559 173.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.86 173.29 30.52 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.405 -0.902 . . . . 0.0 111.145 178.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -58.78 -28.43 65.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.278 0.561 . . . . 0.0 109.714 177.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -57.59 -38.85 75.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.032 -0.985 . . . . 0.0 109.89 175.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.483 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 54.6 m-20 -81.17 -28.34 35.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.37 -177.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . 0.494 ' CE1' HG23 ' A' ' 21' ' ' VAL . 91.7 m-85 -74.02 -18.88 60.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.129 0.49 . . . . 0.0 109.841 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -80.43 -37.21 32.51 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.177 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.43 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 78.8 mt -64.1 162.0 15.1 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.27 178.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.9 m -81.54 162.97 22.97 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 175.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.99 -32.96 72.52 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 120.978 -0.289 . . . . 0.0 111.292 -173.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -66.78 -41.55 93.58 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.024 -0.608 . . . . 0.0 112.14 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.43 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 93.7 mt-30 -66.73 -38.01 85.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.171 0.51 . . . . 0.0 110.193 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 32.8 tp -68.66 -40.66 80.09 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.008 175.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.542 ' HG3' HD13 ' A' ' 57' ' ' ILE . 47.9 ttm -61.54 -29.42 69.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.91 -1.041 . . . . 0.0 110.976 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -81.74 -35.14 30.01 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.97 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -71.98 -52.26 17.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.919 0.39 . . . . 0.0 110.683 -178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -95.35 46.39 1.11 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.515 0.674 . . . . 0.0 109.321 178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.1 tttp -53.37 -35.08 59.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.362 -1.29 . . . . 0.0 113.247 -169.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -109.04 1.31 20.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -120.71 7.16 10.48 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.873 0.368 . . . . 0.0 110.608 -177.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.542 HD13 ' HG3' ' A' ' 50' ' ' MET . 10.9 tt -93.43 123.48 45.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.053 0.454 . . . . 0.0 110.968 -179.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 98.7 t -125.25 129.36 73.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.281 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.446 HG12 HG12 ' A' ' 29' ' ' ILE . 59.7 mt -95.57 108.2 20.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.834 178.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 30.4 m -90.77 142.98 12.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.262 0.553 . . . . 0.0 111.326 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -88.31 115.99 4.51 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.816 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.506 HD22 HG21 ' A' ' 68' ' ' THR . 69.8 mt -105.18 -4.8 21.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.735 0.303 . . . . 0.0 110.665 -179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 7.5 m -62.98 -29.21 70.64 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.321 -174.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -90.65 9.56 29.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.121 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.448 HD12 HG13 ' A' ' 94' ' ' ILE . 58.2 mt -137.72 95.63 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 174.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -75.16 -9.66 58.76 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.916 -176.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -89.81 33.5 0.85 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.641 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.506 HG21 HD22 ' A' ' 62' ' ' LEU . 8.0 p -101.93 21.17 15.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.131 178.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -80.6 -31.26 36.72 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.522 -178.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -74.16 -10.57 59.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.583 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 62.4 tp -71.87 119.82 16.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.919 178.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.2 ttpt -99.39 144.46 28.47 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.507 -175.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -77.63 133.01 38.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 89.75 48.29 3.7 Favored Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -175.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HG2' HD11 ' A' ' 99' ' ' LEU . 6.0 tp10 -140.98 171.44 14.07 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -116.19 139.19 50.6 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 175.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.532 HG22 ' HA ' ' A' ' 99' ' ' LEU . 33.1 pt -139.36 154.68 25.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.27 0.557 . . . . 0.0 111.587 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.444 ' HG3' HG22 ' A' ' 17' ' ' VAL . 38.4 ttpt -116.58 107.0 14.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.168 -0.923 . . . . 0.0 108.899 174.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.529 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 25.3 m -96.85 158.96 3.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-O 121.042 0.449 . . . . 0.0 111.59 -173.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 3.3 m-90 -126.39 122.02 34.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.225 173.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 12.7 p90 -133.28 158.1 43.78 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.183 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -112.72 -12.19 13.41 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.06 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 4.9 m -141.11 137.18 32.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.165 -176.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 37.2 mtm-85 -112.38 140.48 47.06 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 174.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.787 ' HB3' ' HB2' ' A' ' 91' ' ' SER . 82.6 tttt -84.44 117.68 23.8 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -67.92 104.43 1.72 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.362 -179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 67.8 p -162.09 176.36 10.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.356 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 12.8 m120 -134.17 110.57 11.79 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.698 175.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.404 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 11.5 Cg_exo -71.36 156.25 96.84 Favored 'Cis proline' 0 C--O 1.235 0.368 0 C-N-CA 123.772 -1.345 . . . . 0.0 112.609 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.7 138.79 87.7 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.703 2.268 . . . . 0.0 112.149 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.787 ' HB2' ' HB3' ' A' ' 85' ' ' LYS . 21.6 m -112.54 158.32 20.08 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.273 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -150.79 101.38 2.91 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.887 0.375 . . . . 0.0 111.289 -179.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 27.4 m -71.19 115.54 10.45 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 174.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 HD12 ' A' ' 65' ' ' ILE . 37.7 pt -89.8 154.24 3.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.261 0.553 . . . . 0.0 111.736 -171.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -104.76 -23.0 13.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.203 178.541 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 97' ' ' TYR . 51.6 tttt -162.32 159.56 25.61 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.318 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 30.2 p90 -148.89 157.67 43.6 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 175.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -114.48 116.25 28.55 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.74 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.532 ' HA ' HG22 ' A' ' 77' ' ' ILE . 43.7 tp -72.48 108.76 5.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.937 179.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 81.7 mt -98.6 101.69 13.19 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 76.5 mt -61.58 119.73 9.2 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.867 -177.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -57.87 117.25 4.09 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.097 176.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -115.83 117.54 30.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.962 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -61.34 -43.73 98.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.008 0.432 . . . . 0.0 109.951 175.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.4 m-70 -78.25 98.28 5.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.941 173.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 77.1 m-70 -86.6 -16.21 37.44 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.011 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -128.41 145.31 51.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.19 177.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.79 -0.624 . . . . 0.0 109.97 179.331 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.688 ' HG3' ' H ' ' A' ' 2' ' ' ASN . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.688 ' H ' ' HG3' ' A' ' 1' ' ' MET . 18.4 m120 -63.77 146.52 53.74 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.068 0.461 . . . . 0.0 110.647 -179.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 76.3 mttt -88.27 159.26 18.19 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.581 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -81.14 -33.39 33.21 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.592 ' HG2' ' H ' ' A' ' 7' ' ' ASN . 36.5 tt0 -80.19 140.63 36.23 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 174.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 94.2 mt-30 -83.37 -2.02 54.79 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.986 0.422 . . . . 0.0 110.812 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.592 ' H ' ' HG2' ' A' ' 5' ' ' GLU . 79.9 m-20 -118.75 176.14 5.41 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.69 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 68.79 26.91 74.26 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.472 -177.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.06 -36.66 82.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.487 -0.356 . . . . 0.0 110.835 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -74.29 -29.0 61.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.865 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.4 m -61.62 108.07 0.92 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.118 -179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -111.54 115.14 28.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.401 ' HB3' ' HB3' ' A' ' 80' ' ' TRP . 61.3 mtm -128.96 146.66 50.91 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 178.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -87.14 116.77 25.43 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.634 ' HB3' ' CD1' ' A' ' 80' ' ' TRP . 17.8 p -94.15 133.85 37.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.728 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.402 HD12 HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -133.75 130.86 38.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.602 176.78 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -93.74 133.11 35.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.195 179.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -155.66 167.64 33.14 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.301 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -97.0 134.08 40.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.635 0.255 . . . . 0.0 110.776 178.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.2 t -83.64 106.36 14.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 25.5 m -104.34 -34.8 3.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.882 0.372 . . . . 0.0 111.552 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.724 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 84.8 mt -135.82 140.38 44.19 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -136.42 119.26 16.22 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.431 0.634 . . . . 0.0 111.901 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 27' ' ' ARG . 18.7 t70 -97.54 176.33 5.9 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 170.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 -64.21 -38.77 92.23 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.653 0.264 . . . . 0.0 110.453 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -107.65 -41.31 5.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.692 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 24' ' ' ASP . 51.1 mtm-85 -104.2 115.8 31.05 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.108 0.48 . . . . 0.0 112.215 -171.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.455 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -100.96 121.97 42.69 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.209 -0.451 . . . . 0.0 109.873 176.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.724 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 67.6 mt -91.3 110.83 22.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.011 -178.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.3 mt -109.87 147.34 33.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.749 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 15.6 mt -104.8 113.34 41.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.149 174.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.402 HG22 HD12 ' A' ' 16' ' ' LEU . 10.2 p -90.65 -19.18 23.93 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.621 178.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.553 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 34.2 t70 -65.99 119.49 11.44 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 172.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.5 m -75.85 85.96 2.82 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.788 0.804 . . . . 0.0 112.07 -170.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -140.23 136.58 33.51 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 114.592 -1.186 . . . . 0.0 108.635 172.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -72.13 118.2 65.1 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 5.2 Cg_exo -78.81 115.61 3.62 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.603 2.202 . . . . 0.0 111.431 178.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.66 -163.66 25.18 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.774 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -56.36 -44.17 79.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.547 0.213 . . . . 0.0 111.206 -178.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -67.78 -32.75 73.54 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.821 -176.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -65.47 -36.76 84.83 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.125 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -85.72 -6.13 59.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.09 178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -88.03 -26.49 22.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 110.319 176.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 96.5 mt -71.33 147.54 47.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.212 177.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 57.3 p -75.67 161.53 29.01 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.348 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -53.17 -41.86 65.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.559 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.11 -53.15 48.1 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.491 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -64.91 -37.22 86.91 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.812 0.339 . . . . 0.0 111.101 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 33.6 tp -61.23 -44.34 97.42 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.327 0.584 . . . . 0.0 109.849 176.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 51.9 ttm -70.86 -20.41 62.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.074 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.31 -38.63 63.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.197 178.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -79.61 -48.9 13.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.888 0.375 . . . . 0.0 110.94 -179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -91.27 23.67 3.25 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.837 -175.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.409 ' HG2' HD21 ' A' ' 88' ' ' ASN . 84.3 tttt -50.16 -42.26 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -171.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -98.45 12.1 36.1 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' HB2' ' A' ' 33' ' ' ASP . 16.0 t-20 -154.49 34.44 0.41 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.322 0.582 . . . . 0.0 111.19 -177.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.6 tt -119.8 132.43 69.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 174.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.5 t -121.47 125.35 73.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.134 0.492 . . . . 0.0 111.391 -174.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 59.8 mt -101.35 114.87 41.89 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 176.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 92' ' ' ALA . 27.1 m -98.89 145.16 10.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.187 0.518 . . . . 0.0 111.373 -176.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -95.14 114.22 4.8 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.045 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.538 HD13 ' HB ' ' A' ' 68' ' ' THR . 42.4 mt -87.06 4.77 40.71 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.048 0.451 . . . . 0.0 109.914 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 12.9 m -56.84 -37.24 70.98 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.51 -173.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -85.23 -7.21 59.14 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.884 0.373 . . . . 0.0 110.997 -178.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 42.9 mt -94.53 -39.24 10.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.681 176.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 76.08 -37.98 0.32 Allowed 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.351 172.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -130.27 87.83 2.56 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.385 0.612 . . . . 0.0 109.658 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.538 ' HB ' HD13 ' A' ' 62' ' ' LEU . 4.0 m -119.62 24.58 10.54 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 174.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.61 -18.36 52.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.541 -1.663 . . . . 0.0 113.202 -172.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -66.67 -27.5 67.71 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.922 0.391 . . . . 0.0 110.606 -179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 77' ' ' ILE . 3.6 mp -73.81 145.29 45.09 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.342 0.591 . . . . 0.0 111.8 -177.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -119.47 157.88 27.38 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.962 -1.017 . . . . 0.0 109.197 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 73' ' ' ARG . 7.9 ptt180 -76.94 71.7 3.46 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 122.105 0.955 . . . . 0.0 110.768 176.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 162.48 48.7 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.542 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.955 179.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -138.06 -173.88 3.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.948 0.404 . . . . 0.0 111.187 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -126.98 124.75 40.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.962 -0.563 . . . . 0.0 109.757 -176.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.622 HG21 HD21 ' A' ' 71' ' ' LEU . 42.8 pt -136.34 166.85 25.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.644 0.735 . . . . 0.0 112.43 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -131.31 106.94 8.61 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.46 -1.245 . . . . 0.0 108.562 177.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.632 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.4 m -95.86 150.73 4.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -170.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.634 ' CD1' ' HB3' ' A' ' 15' ' ' SER . 5.4 m-90 -116.11 118.31 32.5 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.736 173.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.539 ' HB3' HG22 ' A' ' 94' ' ' ILE . 19.0 p90 -124.77 176.62 6.48 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.905 0.383 . . . . 0.0 111.105 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -93.71 -43.14 8.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.927 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -162.76 177.85 8.97 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.456 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -123.68 136.0 54.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.914 0.388 . . . . 0.0 111.0 -177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -99.13 97.65 8.74 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.509 ' HG2' ' HG3' ' A' ' 90' ' ' PRO . 1.5 tm-20 -87.36 87.89 7.54 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 121.256 0.551 . . . . 0.0 110.141 -174.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.5 p -108.02 2.89 23.48 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.251 175.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.479 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 27.1 t-20 60.18 101.11 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.364 -177.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.479 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 73.9 Cg_endo -75.98 152.38 96.6 Favored 'Cis proline' 0 CA--C 1.53 0.325 0 C-N-CA 123.29 -1.546 . . . . 0.0 112.658 -0.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.509 ' HG3' ' HG2' ' A' ' 86' ' ' GLU . 31.9 Cg_exo -59.09 120.54 8.46 Favored 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.646 2.231 . . . . 0.0 112.003 177.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 10.6 m -105.69 142.69 34.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.053 -0.522 . . . . 0.0 109.635 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 60' ' ' VAL . . . -142.37 121.79 13.19 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.85 0.357 . . . . 0.0 111.443 -177.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 22.6 m -81.49 110.05 16.53 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.539 HG22 ' HB3' ' A' ' 81' ' ' PHE . 37.8 pt -96.43 155.49 3.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.608 -176.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.35 -29.43 5.5 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.464 178.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -135.03 155.17 51.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.885 179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -153.7 148.1 26.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.178 -177.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.458 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 34.3 tt0 -114.69 119.71 37.65 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 53.6 tp -78.6 119.5 21.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.504 -177.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 98.1 mt -103.65 80.86 1.83 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.132 0.491 . . . . 0.0 110.367 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.9 tp -72.8 128.3 35.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.375 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.6 -35.58 80.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.097 0.475 . . . . 0.0 110.696 -175.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -83.72 81.43 8.76 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.243 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -77.21 71.0 3.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.965 0.412 . . . . 0.0 110.027 177.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 57.8 m170 -120.03 -44.62 2.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.604 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -83.6 66.03 8.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.727 0.775 . . . . 0.0 111.868 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 71.8 t60 -114.66 8.57 16.28 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 162.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 32.1 m80 . . . . . 0 C--O 1.247 0.949 0 CA-C-N 113.504 -1.68 . . . . 0.0 108.136 -178.686 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.7 mtt . . . . . 0 N--CA 1.484 1.254 0 CA-C-O 121.111 0.481 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -114.52 -165.68 1.04 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.7 mttm -87.13 -15.42 38.47 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.349 0.595 . . . . 0.0 110.372 176.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -125.01 106.36 9.89 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 174.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -91.22 160.15 15.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.791 0.805 . . . . 0.0 112.493 -170.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -92.77 102.91 15.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.225 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -65.98 151.73 46.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.09 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -82.41 56.57 5.0 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.676 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -167.23 149.04 5.87 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 -178.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -74.74 -28.78 60.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.841 0.353 . . . . 0.0 110.777 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 75.4 p -87.85 -170.1 2.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 96.6 mttt 63.8 29.66 14.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.368 0.604 . . . . 0.0 109.892 -179.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.462 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 75.6 mtm -76.72 143.37 40.02 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.04 175.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -83.63 116.78 22.78 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -175.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.566 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 10.8 t -107.94 139.5 42.47 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.013 -169.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.431 HD12 ' C ' ' A' ' 15' ' ' SER . 6.0 mp -138.47 163.32 32.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.167 -0.924 . . . . 0.0 109.298 174.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.4 t -95.71 140.42 17.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.5 136.84 6.09 Favored Glycine 0 N--CA 1.443 -0.89 0 C-N-CA 120.055 -1.069 . . . . 0.0 112.468 -177.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.0 m-85 -90.25 124.47 34.9 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.966 0.412 . . . . 0.0 110.115 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.525 HG21 HD11 ' A' ' 71' ' ' LEU . 13.9 t -82.01 104.27 10.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.983 -177.269 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 HD21 ' A' ' 49' ' ' LEU . 15.9 m -100.98 -41.28 8.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.177 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.705 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 90.1 mt -130.23 146.1 51.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 110.515 179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -132.85 123.54 26.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.314 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' HB2' ' HB2' ' A' ' 27' ' ' ARG . 67.6 m-20 -101.33 -2.91 29.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 174.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 t30 75.63 -55.59 0.62 Allowed 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.478 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -79.71 -18.91 50.15 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.599 0.714 . . . . 0.0 109.186 175.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.421 ' HB2' ' HB2' ' A' ' 24' ' ' ASP . 14.7 mtm180 -135.16 159.74 40.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.802 175.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.75 127.61 31.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.055 0.455 . . . . 0.0 110.518 175.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.705 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 56.9 mt -95.4 101.53 12.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.456 HD22 HG22 ' A' ' 20' ' ' VAL . 32.4 mt -115.05 140.91 48.67 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.124 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 60.2 mt -90.67 111.47 23.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 173.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.5 p -83.2 -9.34 59.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.306 0.574 . . . . 0.0 110.979 -179.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -90.38 157.58 17.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.324 176.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 25.9 p -89.53 3.44 52.46 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -172.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.42 93.92 4.16 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.044 0.45 . . . . 0.0 109.898 178.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -68.97 128.1 92.89 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.124 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.435 ' HB2' ' HB2' ' A' ' 41' ' ' ASP . 96.3 Cg_endo -78.94 -178.93 5.01 Favored 'Trans proline' 0 C--O 1.238 0.516 0 C-N-CA 123.008 2.472 . . . . 0.0 112.671 -178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.66 -176.37 20.62 Favored Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.521 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 25.1 pttm -68.38 -23.12 64.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.968 0.414 . . . . 0.0 110.637 -177.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 40' ' ' GLU . 27.3 mp0 -70.81 -38.41 73.3 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.377 177.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.435 ' HB2' ' HB2' ' A' ' 37' ' ' PRO . 7.8 m-20 -65.17 -38.54 90.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.491 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -65.94 -19.03 65.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.889 0.376 . . . . 0.0 111.018 175.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.43 -20.48 23.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.939 178.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 48' ' ' GLN . 99.2 mt -74.76 153.37 38.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 177.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.2 p -77.68 168.68 19.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.807 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.52 ' HG3' HD13 ' A' ' 22' ' ' LEU . 1.6 mp0 -53.77 -42.65 68.5 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.77 178.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -56.53 -49.33 70.24 Favored Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 116.002 -0.545 . . . . 0.0 112.222 178.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 77.9 mm-40 -64.11 -43.52 95.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.806 0.336 . . . . 0.0 110.928 179.302 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.519 HD21 HG21 ' A' ' 21' ' ' VAL . 29.1 tp -64.31 -47.23 80.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.245 -177.311 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.458 ' SD ' HD11 ' A' ' 59' ' ' ILE . 68.3 mtm -75.82 -13.36 60.28 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.484 -177.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -89.07 -35.44 16.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.086 0.47 . . . . 0.0 110.295 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -73.38 -49.22 28.36 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.349 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -100.58 47.12 0.93 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 176.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -59.12 121.02 10.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.794 -172.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 69.35 4.83 4.82 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.041 -0.981 . . . . 0.0 112.358 176.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -104.83 5.59 33.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.585 0.707 . . . . 0.0 109.281 173.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.611 HD11 HG22 ' A' ' 29' ' ' ILE . 19.4 tt -126.04 140.14 49.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 114.764 -1.107 . . . . 0.0 109.697 -176.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 92.2 t -122.53 129.07 75.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.124 0.488 . . . . 0.0 111.086 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.458 HD11 ' SD ' ' A' ' 50' ' ' MET . 60.4 mt -94.91 107.76 19.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 175.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.484 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 33.5 m -88.91 145.2 7.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.255 0.55 . . . . 0.0 111.032 -176.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.13 115.19 4.53 Favored Glycine 0 N--CA 1.443 -0.871 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.346 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.634 HD11 ' HB2' ' A' ' 28' ' ' ALA . 87.2 mt -94.98 21.48 7.61 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.005 0.431 . . . . 0.0 110.307 -179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 27.2 p -60.6 -25.79 66.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.333 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -87.45 -9.31 54.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.011 -176.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.439 HD11 ' HA ' ' A' ' 96' ' ' LYS . 47.7 mt -128.32 105.59 13.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.868 0.366 . . . . 0.0 110.23 -177.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -81.66 -11.85 58.92 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.707 -174.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -116.04 82.07 1.71 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.547 0.689 . . . . 0.0 109.813 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.588 HG21 HD13 ' A' ' 62' ' ' LEU . 38.4 p -111.14 17.68 20.11 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.219 -0.901 . . . . 0.0 108.606 174.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.88 -27.32 69.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.341 -1.3 . . . . 0.0 111.306 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -74.73 -23.48 58.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.065 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.525 HD11 HG21 ' A' ' 20' ' ' VAL . 23.9 tp -65.19 131.7 47.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.503 -178.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -117.76 172.8 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.228 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 73' ' ' ARG . 23.8 mtm180 -98.0 137.56 36.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.809 0.338 . . . . 0.0 110.31 176.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 94.33 23.33 22.19 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.566 -0.614 . . . . 0.0 111.566 -177.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -116.97 -173.12 2.33 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.075 0.464 . . . . 0.0 111.404 -174.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.506 ' HG2' HD12 ' A' ' 100' ' ' LEU . 78.3 tttt -141.82 123.21 14.88 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.972 -175.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.7 pt -130.98 168.9 22.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.388 0.613 . . . . 0.0 112.004 -176.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -116.48 117.84 31.02 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.876 -1.057 . . . . 0.0 109.08 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.566 ' O ' ' HA ' ' A' ' 15' ' ' SER . 26.8 m -104.29 148.69 8.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.511 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 6.8 m-90 -125.67 116.76 22.18 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.551 -0.749 . . . . 0.0 110.148 175.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.59 ' HB3' HG22 ' A' ' 94' ' ' ILE . 30.1 p90 -126.05 167.6 15.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.221 0.534 . . . . 0.0 111.886 177.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.71 29.66 2.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.075 177.028 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 14.7 t -172.29 148.22 2.08 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.617 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -149.5 139.39 21.92 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 -178.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -113.43 141.67 46.82 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.141 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -84.25 47.47 1.34 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.852 178.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.9 p -64.85 -37.82 88.89 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 55.57 93.95 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.429 0 O-C-N 123.875 0.735 . . . . 0.0 111.764 179.454 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 38.7 Cg_exo -60.98 135.38 14.62 Favored 'Cis proline' 0 C--N 1.354 0.824 0 C-N-CA 124.163 -1.182 . . . . 0.0 112.788 3.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 89' ' ' PRO . 36.9 Cg_exo -59.43 141.45 97.53 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.125 2.55 . . . . 0.0 113.009 -175.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 6.0 p -116.22 151.09 36.44 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.89 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -145.34 119.15 9.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.741 0.305 . . . . 0.0 110.808 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 45.6 m -78.55 110.72 13.9 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.366 178.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.59 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.1 pt -96.13 143.76 11.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.659 -178.14 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -93.07 -28.81 16.13 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.615 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.439 ' HA ' HD11 ' A' ' 65' ' ' ILE . 67.8 mttm -150.89 159.58 44.46 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.339 178.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -147.65 147.6 30.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.595 176.484 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.511 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 28.0 tt0 -114.42 136.88 52.52 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.185 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 34.4 tp -82.31 120.83 25.9 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.506 HD12 ' HG2' ' A' ' 76' ' ' LYS . 92.9 mt -89.6 118.46 29.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.047 0.451 . . . . 0.0 110.209 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 88.2 mt -81.83 84.23 6.94 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.344 -178.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -70.52 108.43 4.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.106 178.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -76.25 -34.12 59.17 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 173.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -141.7 107.74 5.19 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.051 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -63.32 117.35 6.51 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 -78.93 100.62 7.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.94 -173.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 20.9 t60 -80.73 128.45 33.65 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.11 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 31.7 m170 . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.257 -0.878 . . . . 0.0 109.824 176.897 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.483 ' HB2' ' HA2' ' A' ' 8' ' ' GLY . 93.5 m-20 -86.36 121.97 29.67 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 175.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -53.16 -53.53 49.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.269 -174.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . 0.418 ' ND2' ' HB2' ' A' ' 6' ' ' GLN . 43.5 t30 -85.83 118.16 25.15 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -56.96 -31.11 64.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.426 -178.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.418 ' HB2' ' ND2' ' A' ' 4' ' ' ASN . 96.0 mt-30 -62.95 -27.82 69.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.708 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -102.48 -4.14 25.83 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.442 0.639 . . . . 0.0 109.704 177.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.483 ' HA2' ' HB2' ' A' ' 2' ' ' ASN . . . -74.45 178.92 44.11 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.689 -178.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -92.76 139.9 30.07 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 120.897 0.38 . . . . 0.0 110.646 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -107.3 -71.46 0.75 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 175.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 m -84.82 103.92 14.33 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 173.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -67.61 116.57 8.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.077 0.465 . . . . 0.0 111.399 -176.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.1 mtp -92.2 124.11 36.04 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.522 -0.918 . . . . 0.0 108.522 173.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 80' ' ' TRP . 89.6 mt-30 -83.66 125.27 31.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.173 0.511 . . . . 0.0 110.442 -171.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 7.2 m -100.81 134.47 43.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.809 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.51 HD12 ' CE2' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -117.75 124.37 48.3 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 174.297 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 93.1 t -94.52 117.87 39.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.87 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.61 167.37 29.21 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.85 -179.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.0 m-85 -99.44 146.14 26.66 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 17.9 t -101.23 108.44 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.463 HG22 ' HG2' ' A' ' 37' ' ' PRO . 47.0 t -101.17 -59.66 3.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 120.856 0.36 . . . . 0.0 110.821 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.701 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 85.6 mt -116.65 159.51 22.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.405 -175.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -143.95 124.22 13.8 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.621 -178.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 25' ' ' ASN . 8.1 t70 -77.92 -66.4 0.85 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.124 172.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 49.3 t30 163.72 -60.08 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.322 -1.308 . . . . 0.0 107.662 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -90.62 -17.09 27.5 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 114.827 -1.078 . . . . 0.0 109.68 177.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -124.77 151.07 45.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.493 175.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.532 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -122.73 138.61 54.57 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.17 176.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.701 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 73.3 mt -99.05 104.08 15.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.913 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.8 mt -112.63 156.44 22.71 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.712 -172.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 71.3 mt -106.39 109.0 26.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.229 171.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 25.0 p -83.84 72.55 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.8 0.809 . . . . 0.0 109.763 177.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -157.34 -167.36 2.28 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.606 -175.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.5 t -110.63 -11.98 14.38 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.952 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.68 132.43 46.15 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.057 0.456 . . . . 0.0 111.652 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -99.37 115.87 65.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.265 177.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HG2' HG22 ' A' ' 21' ' ' VAL . 18.1 Cg_exo -66.63 146.17 78.36 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.819 2.346 . . . . 0.0 112.169 -179.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -98.77 -179.36 31.98 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.667 178.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.6 tttp -58.51 -40.07 81.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.849 0.357 . . . . 0.0 110.864 -178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.543 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 31.8 tt0 -64.3 -31.57 72.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.967 178.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -72.03 -35.03 69.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.833 0.349 . . . . 0.0 110.363 178.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -71.73 -25.07 61.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.063 0.459 . . . . 0.0 109.896 174.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -75.37 -27.91 59.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.139 176.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 95.7 mt -65.96 155.84 35.35 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.247 176.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.8 p -90.53 174.07 7.73 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.411 178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.81 -50.96 55.16 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 123.41 0.444 . . . . 0.0 111.821 -176.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -62.62 -42.5 99.69 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.885 -0.674 . . . . 0.0 112.619 -178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -65.71 -39.1 90.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.103 0.478 . . . . 0.0 110.254 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.31 -44.68 94.31 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.145 176.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.667 ' O ' ' HA ' ' A' ' 54' ' ' LYS . 76.2 mtp -67.84 -18.35 64.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.967 -178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -91.56 -21.36 20.89 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.745 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -86.12 -51.32 6.38 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.328 0.585 . . . . 0.0 109.733 175.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -96.23 49.64 1.14 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 176.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.667 ' HA ' ' O ' ' A' ' 50' ' ' MET . 33.6 tttp -53.65 118.21 3.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.133 -1.394 . . . . 0.0 112.522 -170.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 64.89 10.34 6.08 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 114.88 -1.054 . . . . 0.0 112.584 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -106.31 15.26 26.37 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.753 0.787 . . . . 0.0 109.278 175.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.569 HD11 HG23 ' A' ' 29' ' ' ILE . 8.8 tt -107.97 135.53 46.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.634 -1.166 . . . . 0.0 110.335 -176.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.536 HG22 ' HB2' ' A' ' 90' ' ' PRO . 74.6 t -126.76 131.66 70.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.979 0.419 . . . . 0.0 110.854 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' HA ' ' A' ' 91' ' ' SER . 72.2 mt -97.24 109.14 22.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 175.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 92' ' ' ALA . 29.0 m -93.09 140.99 15.36 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-O 121.295 0.569 . . . . 0.0 111.318 -177.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.63 118.65 5.29 Favored Glycine 0 N--CA 1.442 -0.965 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.36 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.658 HD13 HG21 ' A' ' 68' ' ' THR . 11.0 mt -99.26 17.78 19.2 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 -178.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 1.3 p -65.59 -14.23 60.68 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.685 -176.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -86.45 -12.45 49.0 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.004 0.43 . . . . 0.0 110.325 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.479 HG22 ' H ' ' A' ' 67' ' ' ASN . 30.5 mm -117.65 108.8 25.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.982 -0.553 . . . . 0.0 109.893 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -91.98 16.53 10.92 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.468 0.651 . . . . 0.0 110.004 -177.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.479 ' H ' HG22 ' A' ' 65' ' ' ILE . 95.2 m-20 -134.22 31.44 3.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.019 -176.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.658 HG21 HD13 ' A' ' 62' ' ' LEU . 1.7 m -86.45 44.13 1.12 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.378 0.609 . . . . 0.0 111.861 -171.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -87.57 -23.54 24.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.543 178.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -83.58 5.59 23.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.105 0.479 . . . . 0.0 111.074 -177.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.461 HD12 ' CE2' ' A' ' 97' ' ' TYR . 9.9 tt -97.52 115.82 28.55 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 172.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -100.18 -172.36 2.2 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.399 0.618 . . . . 0.0 111.354 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -96.82 141.52 29.93 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.19 168.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 83.45 31.27 28.04 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.818 176.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -119.08 -168.01 1.49 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.932 0.396 . . . . 0.0 110.419 179.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -138.38 134.59 34.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.7 pt -135.63 158.33 39.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.965 0.888 . . . . 0.0 112.421 -176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 38.3 tttt -117.64 106.77 13.45 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 114.071 -1.422 . . . . 0.0 107.932 173.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 19.1 m -100.65 148.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.95 0.405 . . . . 0.0 111.866 -172.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.509 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 7.9 m-90 -106.23 104.92 14.72 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.331 173.381 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.513 ' HB3' HG22 ' A' ' 94' ' ' ILE . 0.0 OUTLIER -107.21 159.08 16.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.057 -177.456 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -112.38 -30.97 6.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.771 178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 22.7 m -134.57 127.17 30.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.973 -178.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 74.4 ttt-85 -119.25 123.61 44.69 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 174.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -125.1 121.03 33.09 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.621 -174.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -82.79 83.6 7.66 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.939 0.4 . . . . 0.0 110.313 179.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 14.0 m -84.24 -13.77 51.74 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.833 175.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.402 ' HA ' ' HA ' ' A' ' 89' ' ' PRO . 66.2 t30 58.12 92.72 0.06 OUTLIER Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.987 -1.006 . . . . 0.0 111.151 -178.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' ASN . 15.0 Cg_exo -67.96 143.64 69.78 Favored 'Cis proline' 0 C--N 1.346 0.421 0 C-N-CA 123.836 -1.318 . . . . 0.0 112.768 2.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.536 ' HB2' HG22 ' A' ' 58' ' ' VAL . 31.7 Cg_exo -58.22 142.7 97.47 Favored 'Trans proline' 0 C--N 1.343 0.272 0 C-N-CA 122.715 2.277 . . . . 0.0 112.327 -179.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.439 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 15.5 m -122.82 156.63 34.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.637 179.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.533 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -146.47 136.36 23.36 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.558 0.218 . . . . 0.0 110.879 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 17.5 m -94.41 114.7 26.77 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 178.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.513 HG22 ' HB3' ' A' ' 81' ' ' PHE . 2.8 pp -104.11 142.0 18.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.782 -177.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -105.22 -9.56 17.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.753 -178.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.27 147.6 2.01 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.461 ' CE2' HD12 ' A' ' 71' ' ' LEU . 4.7 p90 -134.07 146.67 50.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.891 0.377 . . . . 0.0 110.703 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.509 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 33.2 tt0 -116.24 126.45 53.62 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.812 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 39.6 tp -75.97 135.92 40.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.31 0.576 . . . . 0.0 111.4 -176.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.432 HD22 ' CD2' ' A' ' 104' ' ' HIS . 58.3 mt -112.72 105.67 13.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 174.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.2 mt -60.03 -30.15 68.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.726 -174.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.898 ' HG2' ' HD2' ' A' ' 103' ' ' HIS . 43.7 tt0 -141.83 -78.74 0.25 Allowed 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 175.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . 0.898 ' HD2' ' HG2' ' A' ' 102' ' ' GLU . 6.8 p80 -171.73 160.77 5.78 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 176.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . 0.432 ' CD2' HD22 ' A' ' 100' ' ' LEU . 22.2 m-70 -114.13 96.0 5.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.144 0.497 . . . . 0.0 110.295 178.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -91.52 120.2 32.13 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.499 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -106.2 160.06 15.62 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.268 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -111.89 179.82 3.9 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 174.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 42.2 m80 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.056 179.546 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.6 mtm . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 67.37 176.06 0.25 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 122.067 0.937 . . . . 0.0 113.158 171.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -175.76 -53.55 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.775 -1.557 . . . . 0.0 106.972 173.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -89.87 135.28 33.73 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.848 -1.069 . . . . 0.0 108.569 165.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 45.1 mm-40 -54.86 -43.61 73.24 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -175.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -84.58 15.58 3.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.948 0.404 . . . . 0.0 111.743 -173.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -113.4 20.13 16.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.293 0.568 . . . . 0.0 110.025 176.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 177.5 54.52 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.955 178.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 5' ' ' GLU . 5.7 t70 -172.15 -37.0 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.656 0.741 . . . . 0.0 109.31 -172.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 71.82 17.3 5.4 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.793 168.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 51.2 m -81.07 113.12 19.05 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 170.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -99.21 153.5 18.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.095 0.474 . . . . 0.0 110.727 -178.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.511 ' CB ' ' HB3' ' A' ' 80' ' ' TRP . 76.7 mtm -109.74 151.0 27.5 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.372 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -88.56 139.11 30.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.577 -178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 28.6 t -88.88 124.5 34.27 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.963 0.411 . . . . 0.0 110.887 -176.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.36 125.49 42.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.869 -179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 60.7 t -105.33 120.9 56.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.62 174.47 28.26 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.432 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -102.07 136.62 41.59 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 111.029 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.472 HG22 HD22 ' A' ' 30' ' ' LEU . 11.4 t -91.6 102.7 13.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.725 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.41 HG23 ' HG ' ' A' ' 22' ' ' LEU . 17.2 m -100.21 -35.58 4.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 C-N-CA 120.784 -0.367 . . . . 0.0 111.499 -178.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.898 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 70.1 mt -129.72 138.52 51.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.842 0.353 . . . . 0.0 110.765 -176.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 59.5 tttm -148.73 127.92 12.88 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.8 175.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.26 -80.68 0.53 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.773 176.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -144.4 -66.57 0.34 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -89.94 -18.76 25.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.135 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 51.4 mtt180 -119.97 140.21 51.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.492 0.663 . . . . 0.0 112.048 -172.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.577 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -121.62 117.74 27.47 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.156 172.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.898 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 47.5 mt -88.63 105.91 16.18 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.752 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.472 HD22 HG22 ' A' ' 20' ' ' VAL . 20.8 mt -106.42 157.61 17.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.966 -176.163 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.9 mt -103.48 120.55 53.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 175.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -31.81 68.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.195 0.521 . . . . 0.0 110.787 -178.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -79.54 130.31 35.27 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.194 178.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.2 p -75.94 79.06 2.83 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.421 0.629 . . . . 0.0 111.169 -177.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -144.95 144.85 31.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.199 -176.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . . . -89.74 119.58 69.46 Favored Pre-proline 0 C--N 1.323 -0.558 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 173.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 36' ' ' ALA . 50.1 Cg_exo -54.77 -71.63 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 122.906 2.404 . . . . 0.0 112.822 -175.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.43 166.72 14.51 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.433 179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -62.07 -41.2 97.92 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.957 0.408 . . . . 0.0 110.358 -179.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.69 -37.1 81.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.509 179.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.62 -34.82 77.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.389 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -73.84 -12.07 60.57 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.48 177.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -93.15 -23.82 18.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.023 0.44 . . . . 0.0 110.221 177.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 97.9 mt -70.51 152.9 43.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.882 -178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -71.62 155.78 40.13 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.201 177.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.454 ' HG3' HD22 ' A' ' 22' ' ' LEU . 1.8 mp0 -51.14 -49.68 60.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.363 0.414 . . . . 0.0 111.118 -178.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -58.27 -36.09 81.39 Favored Glycine 0 CA--C 1.519 0.323 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.936 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -70.43 -38.94 74.64 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.021 0.439 . . . . 0.0 110.232 179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.69 -38.33 80.23 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.175 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.433 ' HE3' ' HG3' ' A' ' 89' ' ' PRO . 82.8 mtp -63.41 -33.48 75.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.634 177.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -70.11 -38.31 75.59 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.812 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -71.82 -52.25 18.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.857 -177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -96.1 37.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.837 0.351 . . . . 0.0 110.579 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -43.44 -49.51 7.14 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -172.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -108.58 8.38 27.11 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.22 16.22 13.16 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.838 0.351 . . . . 0.0 110.227 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.432 ' O ' ' HD2' ' A' ' 90' ' ' PRO . 8.0 tt -126.42 146.54 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.322 -174.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.532 HG22 ' HB2' ' A' ' 90' ' ' PRO . 59.5 t -134.53 120.8 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.054 0.454 . . . . 0.0 110.446 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 57.1 mt -89.79 105.47 16.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.707 177.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 92' ' ' ALA . 33.8 m -87.25 146.26 6.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.354 0.597 . . . . 0.0 111.271 -176.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -91.4 117.69 5.25 Favored Glycine 0 N--CA 1.441 -1.013 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.816 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.577 HD11 ' HB2' ' A' ' 28' ' ' ALA . 85.9 mt -95.1 7.26 46.69 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.764 0.426 . . . . 0.0 110.009 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.0 p -57.75 -30.61 65.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.712 -175.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -73.45 -35.17 65.72 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.494 -178.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' 96' ' ' LYS . 36.1 mt -104.76 99.23 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.28 -178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -69.37 -21.01 63.83 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.538 -177.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -97.57 37.43 1.37 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.514 0.674 . . . . 0.0 110.885 -176.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.528 HG21 ' HB3' ' A' ' 62' ' ' LEU . 1.0 OUTLIER -83.39 16.28 2.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.929 179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -67.23 -20.48 65.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.201 0.524 . . . . 0.0 110.455 178.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -66.96 -21.09 65.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.628 178.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 77' ' ' ILE . 13.3 tp -76.91 144.49 38.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.318 -178.238 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mttm -132.5 -172.47 2.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.402 -174.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 73' ' ' ARG . 19.0 mtp180 -100.86 129.57 46.74 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.086 -0.339 . . . . 0.0 110.086 173.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 93.41 33.82 6.99 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.053 -0.594 . . . . 0.0 111.879 -178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -106.56 163.45 12.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.014 0.435 . . . . 0.0 111.296 -175.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -120.7 112.62 19.09 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 170.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 71' ' ' LEU . 42.0 pt -125.16 151.88 31.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.453 0.644 . . . . 0.0 111.899 -176.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.422 ' HE3' ' CH2' ' A' ' 80' ' ' TRP . 35.8 ttpt -107.99 107.42 18.11 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.881 175.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.414 ' HA ' ' HA ' ' A' ' 97' ' ' TYR . 34.3 m -100.25 157.98 3.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.016 0.436 . . . . 0.0 111.472 -174.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.511 ' HB3' ' CB ' ' A' ' 13' ' ' MET . 11.0 m-90 -124.62 129.64 50.93 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.047 175.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.525 ' HB3' HG22 ' A' ' 94' ' ' ILE . 4.4 p90 -151.09 161.82 42.02 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.585 178.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -128.49 -35.67 1.93 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.1 m -93.88 106.24 18.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.649 178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 26.6 ttm180 -103.87 133.31 49.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.396 177.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 65.5 tttp -112.69 93.87 4.64 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 176.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.534 ' HA ' ' HA ' ' A' ' 90' ' ' PRO . 43.2 tt0 -92.77 89.61 6.7 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.219 0.533 . . . . 0.0 110.218 -177.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.7 m -103.23 -3.65 25.41 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.267 -175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 63.43 97.3 0.04 OUTLIER Pre-proline 0 N--CA 1.468 0.435 0 O-C-N 123.755 0.66 . . . . 0.0 110.535 -175.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . 0.465 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 57.1 Cg_endo -70.28 150.18 91.03 Favored 'Cis proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.533 -1.445 . . . . 0.0 112.897 1.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.534 ' HA ' ' HA ' ' A' ' 86' ' ' GLU . 38.0 Cg_exo -61.13 146.3 97.76 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.024 2.483 . . . . 0.0 112.633 178.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.7 m -132.29 157.92 43.18 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.929 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.44 ' HB3' HG12 ' A' ' 60' ' ' VAL . . . -147.2 122.27 10.11 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.602 0.239 . . . . 0.0 111.224 -178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 14.4 m -84.23 110.56 18.64 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 110.123 -0.325 . . . . 0.0 110.123 178.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.525 HG22 ' HB3' ' A' ' 81' ' ' PHE . 41.5 pt -101.24 141.52 17.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.264 -174.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HB2' ' SD ' ' A' ' 13' ' ' MET . 95.7 mt-30 -96.75 -21.29 17.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.627 178.154 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.54 ' HA ' HD11 ' A' ' 65' ' ' ILE . 57.8 tttm -158.31 146.02 18.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.539 176.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.414 ' HA ' ' HA ' ' A' ' 79' ' ' VAL . 24.8 p90 -128.0 174.71 8.96 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 171.497 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -143.59 118.71 10.1 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 21.4 tp -73.46 127.8 33.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.481 -178.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 78.2 mt -100.48 139.95 35.43 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 177.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 89.2 mt -79.63 13.67 1.97 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.023 0.44 . . . . 0.0 111.497 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -85.57 64.92 8.91 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.166 -0.47 . . . . 0.0 109.874 176.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -82.52 -57.4 3.36 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.493 0.663 . . . . 0.0 109.277 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 49.5 m-70 -93.57 96.38 9.82 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.272 177.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 56.3 m-70 -72.78 158.05 36.31 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.405 -175.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -118.2 136.82 53.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.056 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 17.1 t-160 -77.11 -32.77 56.79 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 . . . . . 0 C--O 1.247 0.967 0 CA-C-O 118.171 -0.919 . . . . 0.0 109.571 176.216 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtt . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 120.904 0.383 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -84.53 -32.15 24.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.807 177.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 79.4 mttt -94.76 -165.04 1.24 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.563 -177.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -104.31 -17.15 14.94 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -173.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 5' ' ' GLU . 2.4 mp0 -65.62 107.18 1.65 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -79.14 98.79 6.69 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.23 0.538 . . . . 0.0 110.27 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -119.76 162.17 19.51 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.768 -178.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.67 -143.79 3.58 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.215 179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -130.91 136.4 48.57 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -65.32 -34.83 79.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.166 0.508 . . . . 0.0 110.377 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.6 m -79.14 94.38 5.36 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.736 178.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.0 tttp -72.24 104.52 3.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.583 177.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 71.2 mtp -87.62 107.52 18.65 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.999 -174.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -100.63 125.49 47.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.619 ' HA ' ' O ' ' A' ' 79' ' ' VAL . 60.0 p -92.52 149.56 21.29 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.283 0.564 . . . . 0.0 112.0 -174.485 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.423 HD22 ' HA ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -146.74 131.47 17.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.181 175.507 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 83.4 t -98.18 126.32 51.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 177.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -148.66 158.79 27.8 Favored Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.416 -178.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.411 ' HE1' ' HA ' ' A' ' 34' ' ' THR . 97.6 m-85 -84.8 124.2 31.29 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.695 0.283 . . . . 0.0 110.645 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.434 ' HA ' HD22 ' A' ' 30' ' ' LEU . 15.0 t -81.68 107.95 14.32 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 175.3 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.502 HG11 ' HG2' ' A' ' 37' ' ' PRO . 27.1 m -114.99 -41.29 3.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.737 0.303 . . . . 0.0 111.665 -176.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.739 ' HB2' ' HB ' ' A' ' 29' ' ' ILE . 71.7 mt -120.94 144.72 48.31 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 176.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 68' ' ' THR . 48.4 tttm -148.36 132.04 16.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 0.0 111.65 -177.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -111.82 -165.19 0.97 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 169.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -90.19 -25.92 20.39 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.426 0.631 . . . . 0.0 109.542 174.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -94.15 -32.48 13.71 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.645 -177.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.0 mtm-85 -143.9 161.48 38.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.86 0.362 . . . . 0.0 111.048 -171.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.554 ' HB2' HD11 ' A' ' 62' ' ' LEU . . . -134.63 127.35 31.0 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.711 173.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.739 ' HB ' ' HB2' ' A' ' 22' ' ' LEU . 37.6 mt -93.83 111.21 24.64 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 N-CA-C 109.855 -0.424 . . . . 0.0 109.855 -177.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 20' ' ' VAL . 23.8 mt -112.42 148.96 33.25 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.689 -174.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 53.2 mt -98.49 119.29 46.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 174.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 p -85.76 -14.37 45.46 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.141 0.495 . . . . 0.0 110.793 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -75.7 163.15 27.59 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 174.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.411 ' HA ' ' HE1' ' A' ' 19' ' ' TYR . 25.5 p -89.48 -11.85 41.76 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -175.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 47.2 tptt -76.69 105.58 7.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.083 0.468 . . . . 0.0 110.695 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.98 137.58 61.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.209 176.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.502 ' HG2' HG11 ' A' ' 21' ' ' VAL . 24.1 Cg_exo -63.61 151.5 84.77 Favored 'Trans proline' 0 C--O 1.233 0.27 0 C-N-CA 123.087 2.524 . . . . 0.0 112.62 -178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -93.98 -175.62 39.49 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.942 -0.646 . . . . 0.0 111.932 177.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -51.75 -53.34 40.76 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 122.831 0.453 . . . . 0.0 111.621 -178.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.479 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 4.2 mp0 -67.97 -26.82 66.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.342 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -69.89 -35.23 74.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.678 0.275 . . . . 0.0 110.775 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -72.37 -18.44 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.962 0.41 . . . . 0.0 110.526 175.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -87.05 -22.09 25.67 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.539 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 40' ' ' GLU . 98.9 mt -63.9 151.53 42.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.4 p -75.23 163.13 27.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.976 0.417 . . . . 0.0 111.109 -178.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.409 ' HG2' ' HE3' ' A' ' 50' ' ' MET . 41.2 tt0 -53.35 -45.64 69.21 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.319 -177.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -60.88 -47.0 93.41 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.062 -0.589 . . . . 0.0 112.577 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -61.57 -40.21 93.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.897 0.379 . . . . 0.0 110.682 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.2 tp -63.48 -43.27 97.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.389 179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.409 ' HE3' ' HG2' ' A' ' 46' ' ' GLU . 66.0 mtt -66.64 -24.65 66.33 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.239 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -85.76 -35.91 20.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.274 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -73.04 -37.67 66.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.911 0.386 . . . . 0.0 110.652 178.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -107.68 39.2 1.97 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.229 0.538 . . . . 0.0 109.906 176.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -52.85 121.72 7.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.936 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 63.5 t30 73.84 -7.47 1.59 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.844 173.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 56' ' ' ASN . 11.5 m120 -109.48 15.81 22.71 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.572 0.701 . . . . 0.0 110.106 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 21.0 tt -126.63 130.2 71.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.016 179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.507 HG22 ' HG2' ' A' ' 90' ' ' PRO . 95.2 t -115.44 128.83 72.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.097 0.475 . . . . 0.0 111.188 -172.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HA ' ' A' ' 91' ' ' SER . 57.4 mt -94.34 101.94 13.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.631 176.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 35.6 m -80.99 145.94 8.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-O 121.102 0.477 . . . . 0.0 110.639 -179.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 114.54 4.32 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 115.663 -0.699 . . . . 0.0 112.308 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' ' 28' ' ' ALA . 89.3 mt -98.76 13.74 31.22 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 177.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.0 t -61.48 -22.21 64.87 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.196 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -106.36 4.21 28.31 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 121.002 0.429 . . . . 0.0 110.709 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 57.8 mt -116.54 117.19 54.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 121.022 0.439 . . . . 0.0 110.608 -177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -92.14 -32.79 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.2 0.524 . . . . 0.0 111.056 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -80.7 43.99 0.7 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.593 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . 0.521 ' O ' ' HE3' ' A' ' 23' ' ' LYS . 69.0 p -87.1 10.84 15.4 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 122.12 -0.363 . . . . 0.0 110.699 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -75.38 -36.09 60.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.849 -178.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -84.37 -13.5 52.12 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.105 0.478 . . . . 0.0 110.0 176.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.2 tp -79.28 100.74 7.67 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.654 175.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -106.22 148.12 28.29 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.598 -174.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.462 ' HD2' ' O ' ' A' ' 21' ' ' VAL . 15.4 ptt180 -91.52 152.35 20.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.906 0.384 . . . . 0.0 110.238 177.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 100.87 25.67 8.37 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -169.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -150.01 -164.44 2.02 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.972 0.415 . . . . 0.0 111.132 -173.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.6 mtmp? -131.47 141.55 49.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.243 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 29.8 pt -134.2 148.95 29.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 120.991 0.424 . . . . 0.0 110.945 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.459 ' HB3' ' HB3' ' A' ' 98' ' ' GLU . 50.0 tttp -103.31 106.83 17.44 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 175.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.619 ' O ' ' HA ' ' A' ' 15' ' ' SER . 35.1 m -97.17 147.09 6.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 C-N-CA 120.955 -0.298 . . . . 0.0 111.498 -173.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 98' ' ' GLU . 16.0 m-90 -112.48 109.79 19.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.759 173.266 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.454 ' HB3' HG22 ' A' ' 94' ' ' ILE . 14.2 p90 -120.8 179.27 4.4 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.471 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -142.54 -38.72 0.36 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.36 178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.5 m -110.41 121.72 45.98 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.68 178.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 31.8 ptt180 -108.87 132.97 53.51 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.24 0.543 . . . . 0.0 110.21 175.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -99.7 124.11 44.62 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.233 -174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -79.95 50.54 1.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.066 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 22.7 t -71.91 -29.29 64.16 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.585 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.4 t30 60.77 99.09 0.04 OUTLIER Pre-proline 0 N--CA 1.47 0.556 0 O-C-N 123.812 0.695 . . . . 0.0 111.268 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.83 153.31 79.86 Favored 'Cis proline' 0 C--N 1.344 0.341 0 C-N-CA 123.579 -1.425 . . . . 0.0 112.764 1.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' VAL . 12.5 Cg_endo -56.16 138.81 84.3 Favored 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.918 2.412 . . . . 0.0 112.536 -177.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 59' ' ' ILE . 20.8 t -118.35 137.88 52.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.435 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -128.38 102.83 6.83 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.867 0.365 . . . . 0.0 111.077 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.9 m -68.99 112.23 5.49 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.467 HG21 ' HB ' ' A' ' 79' ' ' VAL . 34.4 pt -106.19 147.88 11.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.018 0.437 . . . . 0.0 111.022 -175.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -111.1 -25.29 9.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.44 177.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -142.16 137.56 30.96 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.251 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 26.1 p90 -140.03 153.6 46.86 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.185 -0.461 . . . . 0.0 109.92 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.469 ' HB2' ' CH2' ' A' ' 80' ' ' TRP . 40.8 tt0 -114.9 128.76 56.48 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.815 178.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.89 105.85 10.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.384 -178.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 78' ' ' LYS . 84.0 mt -85.07 78.57 9.86 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 30.1 tp -64.62 125.78 25.82 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.334 -175.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -89.21 160.15 17.1 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.084 176.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -85.19 -32.9 22.43 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 171.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 78.2 m80 -81.61 106.11 13.3 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.711 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' HIS . . . . . . . . . . . . . 27.6 m170 -126.93 147.29 50.1 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.974 176.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -85.95 5.78 31.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.201 0.524 . . . . 0.0 110.166 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 71.3 t60 -143.35 131.86 22.32 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.762 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 33.3 m80 . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.599 -0.715 . . . . 0.0 110.062 176.205 . . . . . . . . 0 0 . 1 stop_ save_